Registration Dossier

Identification

Chemical structure
Display Name:
Reference substance 001
Molecular formula:
Not applicable (a generic Molecular formula cannot be provided for this substance)

Type of substance

Composition:
multi-constituent substance
Origin:
organic

Other names

Trade names:
Patchouli DM
Patchouli Essential Oil
Patchouli ext.
Patchouli heart / Patchouli coeur
Patchouli LCTP
Patchouli Oil
Patchouli Oil Dark
PATCHOULI OIL INDON
Patchouli Oil Light
Patchouli Oil Light Iron Free
PATCHOULI OIL LIGHT IRONFREE
Patchouli, ext
Patchouli, ext.

Total tonnage band

Total range:
10 000 - 100 000 tonnes per annum

REACH

Registered as:
FULL
Submitted:
Joint Submission

Publication dates

First published:
05-Sep-2013
Last modified:
24-Jul-2019

Chemical safety assessment

Performed for this substance:
YES

Compositions open all close all

Type:
legal entity composition of the substance
State Form:
liquid


Constituent 1
Chemical structure
Reference substance name:
641-402-1
EC Number:
641-402-1
CAS Number:
3691-12-1
Molecular formula:
C15 H24
IUPAC Name:
641-402-1
Constituent 2
Reference substance name:
21682-90-6
CAS Number:
21682-90-6
Molecular formula:
C15H26O
IUPAC Name:
21682-90-6
Constituent 3
Reference substance name:
3691-11-0
CAS Number:
3691-11-0
Molecular formula:
C15H24
IUPAC Name:
3691-11-0
Type:
boundary composition of the substance
State Form:
liquid


Constituent 1
Chemical structure
Reference substance name:
3,8-dimethyl-5-(prop-1-en-2-yl)-1,2,3,3a,4,5,6,7-octahydroazulene
CAS Number:
3691-11-0
Molecular formula:
C15H24
IUPAC Name:
3,8-dimethyl-5-(prop-1-en-2-yl)-1,2,3,3a,4,5,6,7-octahydroazulene
Constituent 2
Chemical structure
Reference substance name:
1,4-dimethyl-7-(prop-1-en-2-yl)-1,2,3,4,5,6,7,8-octahydroazulene
CAS Number:
3691-12-1
Molecular formula:
C15H24
IUPAC Name:
1,4-dimethyl-7-(prop-1-en-2-yl)-1,2,3,4,5,6,7,8-octahydroazulene
Constituent 3
Chemical structure
Reference substance name:
4,8a,9,9-tetramethyldecahydro-1,6-methanonaphthalen-1-ol
CAS Number:
21682-90-6
Molecular formula:
C15H26O
IUPAC Name:
4,8a,9,9-tetramethyldecahydro-1,6-methanonaphthalen-1-ol
Type:
legal entity composition of the substance
State Form:
liquid


Constituent 1
Chemical structure
Reference substance name:
4,8a,9,9-tetramethyldecahydro-1,6-methanonaphthalen-1-ol
CAS Number:
21682-90-6
Molecular formula:
C15H26O
IUPAC Name:
4,8a,9,9-tetramethyldecahydro-1,6-methanonaphthalen-1-ol
Constituent 2
Chemical structure
Reference substance name:
3,8-dimethyl-5-(prop-1-en-2-yl)-1,2,3,3a,4,5,6,7-octahydroazulene
CAS Number:
3691-11-0
Molecular formula:
C15H24
IUPAC Name:
3,8-dimethyl-5-(prop-1-en-2-yl)-1,2,3,3a,4,5,6,7-octahydroazulene
Constituent 3
Chemical structure
Reference substance name:
1,4-dimethyl-7-(prop-1-en-2-yl)-1,2,3,4,5,6,7,8-octahydroazulene
CAS Number:
3691-12-1
Molecular formula:
C15H24
IUPAC Name:
1,4-dimethyl-7-(prop-1-en-2-yl)-1,2,3,4,5,6,7,8-octahydroazulene
Type:
legal entity composition of the substance
State Form:
liquid


Constituent 1
Chemical structure
Reference substance name:
1,4-dimethyl-7-(prop-1-en-2-yl)-1,2,3,4,5,6,7,8-octahdroazulene
CAS Number:
3691-12-1
Molecular formula:
C15H24
IUPAC Name:
1,4-dimethyl-7-(prop-1-en-2-yl)-1,2,3,4,5,6,7,8-octahdroazulene
Constituent 2
Chemical structure
Reference substance name:
4,8a,9,9-tetramethyldecahydro-1,6-methanonaphthalen-1-ol
CAS Number:
21682-90-6
Molecular formula:
C15H26O
IUPAC Name:
4,8a,9,9-tetramethyldecahydro-1,6-methanonaphthalen-1-ol
Constituent 3
Chemical structure
Reference substance name:
(3S,3aS,5R)-3,8-dimethyl-5-prop-1-en-2-yl-1,2,3,3a,4,5,6,7-octahydroazulene
CAS Number:
3691-11-0
Molecular formula:
C15H24
IUPAC Name:
(3S,3aS,5R)-3,8-dimethyl-5-prop-1-en-2-yl-1,2,3,3a,4,5,6,7-octahydroazulene
Constituent 4
Chemical structure
Reference substance name:
[1S-(1α,4α,7α)]-1,2,3,4,5,6,7,8-octahydro-1,4,9,9-tetramethyl-4,7-methanoazulene
CAS Number:
514-51-2
Molecular formula:
C15H24
IUPAC Name:
[1S-(1α,4α,7α)]-1,2,3,4,5,6,7,8-octahydro-1,4,9,9-tetramethyl-4,7-methanoazulene
Constituent 5
Chemical structure
Reference substance name:
(1S,2R,4S)-1-ethenyl-1-methyl-2,4-bis(prop-1-en-2-yl)cyclohexane
CAS Number:
515-13-9
Molecular formula:
C15H24
IUPAC Name:
(1S,2R,4S)-1-ethenyl-1-methyl-2,4-bis(prop-1-en-2-yl)cyclohexane
Constituent 6
Chemical structure
Reference substance name:
4S,5S,5aS)-1a,1b,4,5a-tetramethyldecahydro-1,5-methanocyclopropa[a]indene
CAS Number:
86562-17-6
Molecular formula:
C15H24
IUPAC Name:
4S,5S,5aS)-1a,1b,4,5a-tetramethyldecahydro-1,5-methanocyclopropa[a]indene
Constituent 7
Chemical structure
Reference substance name:
Caryophyllene
EC Number:
201-746-1
EC Name:
Caryophyllene
CAS Number:
87-44-5
Molecular formula:
C15H24
IUPAC Name:
4,11,11-trimethyl-8-methylenebicyclo[7.2.0]undec-4-ene
Constituent 8
Chemical structure
Reference substance name:
1,6-Methanonaphthalene, decahydro-1,4,8a-trimethyl-9-methylene-, [1S-(1α,4α,4a-β,6α,8aβ)]-
CAS Number:
20085-93-2
Molecular formula:
C15H24
IUPAC Name:
1,6-Methanonaphthalene, decahydro-1,4,8a-trimethyl-9-methylene-, [1S-(1α,4α,4a-β,6α,8aβ)]-
Constituent 9
Chemical structure
Reference substance name:
1,4,9,9-tetramethyl-2,3,6,7,8,8a-hexahydro-1H-3a,7-methanoazulene
CAS Number:
560-32-7
Molecular formula:
C15H24
IUPAC Name:
1,4,9,9-tetramethyl-2,3,6,7,8,8a-hexahydro-1H-3a,7-methanoazulene
Constituent 10
Chemical structure
Reference substance name:
(5R,8S,8aS)-3,8-dimethyl-5-(prop-1-en-2-yl)-1,2,4,5,6,7,8,8a-octahydroazulene
CAS Number:
87745-31-1
Molecular formula:
C15H24
IUPAC Name:
(5R,8S,8aS)-3,8-dimethyl-5-(prop-1-en-2-yl)-1,2,4,5,6,7,8,8a-octahydroazulene
Constituent 11
Chemical structure
Reference substance name:
8a,9,9-trimethyl-1,2,4a,5,6,7,8,8a-octahydro-1,6-methanonaphthalen-1-ol
CAS Number:
41429-52-1
Molecular formula:
C14H22O
IUPAC Name:
8a,9,9-trimethyl-1,2,4a,5,6,7,8,8a-octahydro-1,6-methanonaphthalen-1-ol
Constituent 12
Chemical structure
Reference substance name:
(1S,7R)-1,4-dimethyl-7-(prop-1-en-2-yl)decahydroazulen-4-ol
CAS Number:
21698-41-9
Molecular formula:
C15H26O
IUPAC Name:
(1S,7R)-1,4-dimethyl-7-(prop-1-en-2-yl)decahydroazulen-4-ol
Type:
legal entity composition of the substance
State Form:
liquid


Constituent 1
Chemical structure
Reference substance name:
1,4-dimethyl-7-(prop-1-en-2-yl)-1,2,3,4,5,6,7,8-octahydroazulene
CAS Number:
3691-12-1
Molecular formula:
C15H24
IUPAC Name:
1,4-dimethyl-7-(prop-1-en-2-yl)-1,2,3,4,5,6,7,8-octahydroazulene
Constituent 2
Chemical structure
Reference substance name:
3,8-dimethyl-5-(prop-1-en-2-yl)-1,2,3,3a,4,5,6,7-octahydroazulene
CAS Number:
3691-11-0
Molecular formula:
C15H24
IUPAC Name:
3,8-dimethyl-5-(prop-1-en-2-yl)-1,2,3,3a,4,5,6,7-octahydroazulene
Constituent 3
Chemical structure
Reference substance name:
4,8a,9,9-tetramethyldecahydro-1,6-methanonaphthalen-1-ol
CAS Number:
21682-90-6
Molecular formula:
C15H26O
IUPAC Name:
4,8a,9,9-tetramethyldecahydro-1,6-methanonaphthalen-1-ol
Type:
legal entity composition of the substance
State Form:
liquid


Constituent 1
Chemical structure
Reference substance name:
Azulene, 1,2,3,4,5,6,7,8-octahydro-1,4-dimethyl-7-(1-methylethenyl)-, (1S,4S,7R)-
CAS Number:
3691-12-1
Molecular formula:
C15H24
IUPAC Name:
Azulene, 1,2,3,4,5,6,7,8-octahydro-1,4-dimethyl-7-(1-methylethenyl)-, (1S,4S,7R)-
Constituent 2
Chemical structure
Reference substance name:
3,8-dimethyl-5-(prop-1-en-2-yl)-1,2,3,3a,4,5,6,7-octahydroazulene
CAS Number:
3691-11-0
Molecular formula:
C15H24
IUPAC Name:
3,8-dimethyl-5-(prop-1-en-2-yl)-1,2,3,3a,4,5,6,7-octahydroazulene
Constituent 3
Chemical structure
Reference substance name:
4,8a,9,9-tetramethyldecahydro-1,6-methanonaphthalen-1-ol
CAS Number:
21682-90-6
Molecular formula:
C15H26O
IUPAC Name:
4,8a,9,9-tetramethyldecahydro-1,6-methanonaphthalen-1-ol
Type:
legal entity composition of the substance
Degree of purity:
>= 45 - < 90 % (w/w)


Constituent 1
Chemical structure
Reference substance name:
1,4-dimethyl-7-(prop-1-en-2-yl)-1,2,3,4,5,6,7,8-octahydroazulene
CAS Number:
3691-12-1
Molecular formula:
C15H24
IUPAC Name:
1,4-dimethyl-7-(prop-1-en-2-yl)-1,2,3,4,5,6,7,8-octahydroazulene
Constituent 2
Chemical structure
Reference substance name:
3,8-dimethyl-5-(prop-1-en-2-yl)-1,2,3,3a,4,5,6,7-octahydroazulene
CAS Number:
3691-11-0
Molecular formula:
C15H24
IUPAC Name:
3,8-dimethyl-5-(prop-1-en-2-yl)-1,2,3,3a,4,5,6,7-octahydroazulene
Constituent 3
Chemical structure
Reference substance name:
[1R-(1α,4β,4aα,6β,8aα)]-octahydro-4,8a,9,9-tetramethyl-1,6-methano-1(2H)-naphthol
EC Number:
227-807-2
EC Name:
[1R-(1α,4β,4aα,6β,8aα)]-octahydro-4,8a,9,9-tetramethyl-1,6-methano-1(2H)-naphthol
CAS Number:
5986-55-0
Molecular formula:
C15H26O
IUPAC Name:
4,8a,9,9-tetramethyldecahydro-1,6-methanonaphthalen-1-ol
Impurity 1
Chemical structure
Reference substance name:
8-isopropyl-1,3-dimethyltricyclo[4.4.0.02,7]dec-3-ene
EC Number:
223-364-4
EC Name:
8-isopropyl-1,3-dimethyltricyclo[4.4.0.02,7]dec-3-ene
CAS Number:
3856-25-5
Molecular formula:
C15H24
IUPAC Name:
8-isopropyl-1,3-dimethyltricyclo[4.4.0.0~2,7~]dec-3-ene
Impurity 2
Chemical structure
Reference substance name:
[1S-(1α,4α,7α)]-1,2,3,4,5,6,7,8-octahydro-1,4,9,9-tetramethyl-4,7-methanoazulene
EC Number:
208-182-5
EC Name:
[1S-(1α,4α,7α)]-1,2,3,4,5,6,7,8-octahydro-1,4,9,9-tetramethyl-4,7-methanoazulene
CAS Number:
514-51-2
Molecular formula:
C15H24
IUPAC Name:
1,4,9,9-tetramethyl-1,2,3,4,5,6,7,8-octahydro-4,7-methanoazulene
Impurity 3
Chemical structure
Reference substance name:
1-methyl-2,4-di(prop-1-en-2-yl)-1-vinylcyclohexane
CAS Number:
515-13-9
Molecular formula:
C15H24
IUPAC Name:
1-methyl-2,4-di(prop-1-en-2-yl)-1-vinylcyclohexane
Impurity 4
Chemical structure
Reference substance name:
4S,5S,5aS)-1a,1b,4,5a-tetramethyldecahydro-1,5-methanocyclopropa[a]indene
CAS Number:
86562-17-6
Molecular formula:
C15H24
IUPAC Name:
4S,5S,5aS)-1a,1b,4,5a-tetramethyldecahydro-1,5-methanocyclopropa[a]indene
Impurity 5
Chemical structure
Reference substance name:
Caryophyllene
EC Number:
201-746-1
EC Name:
Caryophyllene
CAS Number:
87-44-5
Molecular formula:
C15H24
IUPAC Name:
4,11,11-trimethyl-8-methylenebicyclo[7.2.0]undec-4-ene
Impurity 6
Chemical structure
Reference substance name:
1,4,8a-trimethyl-9-methylenedecahydro-1,6-methanonaphthalene
CAS Number:
20085-93-2
Molecular formula:
C15H24
IUPAC Name:
1,4,8a-trimethyl-9-methylenedecahydro-1,6-methanonaphthalene
Impurity 7
Chemical structure
Reference substance name:
Humulene
EC Number:
229-816-7
EC Name:
Humulene
CAS Number:
6753-98-6
Molecular formula:
C15H24
IUPAC Name:
2,6,6,9-tetramethylcycloundeca-1,4,8-triene
Impurity 8
Chemical structure
Reference substance name:
1,4,9,9-tetramethyl-2,3,6,7,8,8a-hexahydro-1H-3a,7-methanoazulene
CAS Number:
560-32-7
Molecular formula:
C15H24
IUPAC Name:
1,4,9,9-tetramethyl-2,3,6,7,8,8a-hexahydro-1H-3a,7-methanoazulene
Impurity 9
Chemical structure
Reference substance name:
(1S,4R,7R,8aS)-1,4,9,9-tetramethyl-1,2,4,5,6,7,8,8a-octahydro-4,7-methanoazulene
CAS Number:
53823-16-8
Molecular formula:
C15H24
IUPAC Name:
(1S,4R,7R,8aS)-1,4,9,9-tetramethyl-1,2,4,5,6,7,8,8a-octahydro-4,7-methanoazulene
Impurity 10
Chemical structure
Reference substance name:
(5R,8S,8aS)-3,8-dimethyl-5-(prop-1-en-2-yl)-1,2,4,5,6,7,8,8a-octahydroazulene
CAS Number:
87745-31-1
Molecular formula:
C15H24
IUPAC Name:
(5R,8S,8aS)-3,8-dimethyl-5-(prop-1-en-2-yl)-1,2,4,5,6,7,8,8a-octahydroazulene
Impurity 11
Chemical structure
Reference substance name:
8a,9,9-trimethyl-1,2,4a,5,6,7,8,8a-octahydro-1,6-methanonaphthalen-1-ol
CAS Number:
41429-52-1
Molecular formula:
C14H22O
IUPAC Name:
8a,9,9-trimethyl-1,2,4a,5,6,7,8,8a-octahydro-1,6-methanonaphthalen-1-ol
Impurity 12
Chemical structure
Reference substance name:
(1S,7R)-1,4-dimethyl-7-(prop-1-en-2-yl)decahydroazulen-4-ol
CAS Number:
21698-41-9
Molecular formula:
C15H26O
IUPAC Name:
(1S,7R)-1,4-dimethyl-7-(prop-1-en-2-yl)decahydroazulen-4-ol
Impurity 13
Chemical structure
Reference substance name:
4-hydroxy-6-methyl-3-(4-methylpentanoyl)-2H-pyran-2-one
CAS Number:
23800-56-8
Molecular formula:
C12H16O4
IUPAC Name:
4-hydroxy-6-methyl-3-(4-methylpentanoyl)-2H-pyran-2-one
Impurity 14
Chemical structure
Reference substance name:
(1R,4E,9R)-4,11,11-trimethyl-8-methylidenebicyclo[7.2.0]undec-4-ene
CAS Number:
68832-35-9
Molecular formula:
C15H24
IUPAC Name:
(1R,4E,9R)-4,11,11-trimethyl-8-methylidenebicyclo[7.2.0]undec-4-ene
Impurity 15
Chemical structure
Reference substance name:
(3S,4aR,8aS)-8a-methyl-5-methylidene-3-prop-1-en-2-yl-1,2,3,4,4a,6,7,8-octahydronaphthalene
CAS Number:
17066-67-0
Molecular formula:
C15H24
IUPAC Name:
(3S,4aR,8aS)-8a-methyl-5-methylidene-3-prop-1-en-2-yl-1,2,3,4,4a,6,7,8-octahydronaphthalene
Type:
legal entity composition of the substance
State Form:
liquid


Constituent 1
Chemical structure
Reference substance name:
641-402-1
EC Number:
641-402-1
CAS Number:
3691-12-1
Molecular formula:
C15 H24
IUPAC Name:
641-402-1
Constituent 2
Reference substance name:
21682-90-6
CAS Number:
21682-90-6
Molecular formula:
C15H26O
IUPAC Name:
21682-90-6
Constituent 3
Reference substance name:
3691-11-0
CAS Number:
3691-11-0
Molecular formula:
C15H24
IUPAC Name:
3691-11-0
Type:
legal entity composition of the substance
State Form:
liquid


Constituent 1
Chemical structure
Reference substance name:
1,4-dimethyl-7-(prop-1-en-2-yl)-1,2,3,4,5,6,7,8-octahydroazulene
CAS Number:
3691-12-1
Molecular formula:
C15H24
IUPAC Name:
1,4-dimethyl-7-(prop-1-en-2-yl)-1,2,3,4,5,6,7,8-octahydroazulene
Constituent 2
Chemical structure
Reference substance name:
3,8-dimethyl-5-(prop-1-en-2-yl)-1,2,3,3a,4,5,6,7-octahydroazulene
CAS Number:
3691-11-0
Molecular formula:
C15H24
IUPAC Name:
3,8-dimethyl-5-(prop-1-en-2-yl)-1,2,3,3a,4,5,6,7-octahydroazulene
Constituent 3
Chemical structure
Reference substance name:
4,8a,9,9-tetramethyldecahydro-1,6-methanonaphthalen-1-ol
CAS Number:
21682-90-6
Molecular formula:
C15H26O
IUPAC Name:
4,8a,9,9-tetramethyldecahydro-1,6-methanonaphthalen-1-ol
Type:
legal entity composition of the substance
State Form:
liquid


Constituent 1
Chemical structure
Reference substance name:
1,4-dimethyl-7-(prop-1-en-2-yl)-1,2,3,4,5,6,7,8-octahydroazulene
CAS Number:
3691-12-1
Molecular formula:
C15H24
IUPAC Name:
1,4-dimethyl-7-(prop-1-en-2-yl)-1,2,3,4,5,6,7,8-octahydroazulene
Constituent 2
Chemical structure
Reference substance name:
3,8-dimethyl-5-(prop-1-en-2-yl)-1,2,3,3a,4,5,6,7-octahydroazulene
CAS Number:
3691-11-0
Molecular formula:
C15H24
IUPAC Name:
3,8-dimethyl-5-(prop-1-en-2-yl)-1,2,3,3a,4,5,6,7-octahydroazulene
Constituent 3
Chemical structure
Reference substance name:
4,8a,9,9-tetramethyldecahydro-1,6-methanonaphthalen-1-ol
CAS Number:
21682-90-6
Molecular formula:
C15H26O
IUPAC Name:
4,8a,9,9-tetramethyldecahydro-1,6-methanonaphthalen-1-ol
Type:
legal entity composition of the substance
State Form:
liquid


Constituent 1
Chemical structure
Reference substance name:
3,8-dimethyl-5-(prop-1-en-2-yl)-1,2,3,3a,4,5,6,7-octahydroazulene
CAS Number:
3691-11-0
Molecular formula:
C15H24
IUPAC Name:
3,8-dimethyl-5-(prop-1-en-2-yl)-1,2,3,3a,4,5,6,7-octahydroazulene
Constituent 2
Chemical structure
Reference substance name:
1,4-dimethyl-7-(prop-1-en-2-yl)-1,2,3,4,5,6,7,8-octahydroazulene
CAS Number:
3691-12-1
Molecular formula:
C15H24
IUPAC Name:
1,4-dimethyl-7-(prop-1-en-2-yl)-1,2,3,4,5,6,7,8-octahydroazulene
Constituent 3
Chemical structure
Reference substance name:
4,8a,9,9-tetramethyldecahydro-1,6-methanonaphthalen-1-ol
CAS Number:
21682-90-6
Molecular formula:
C15H26O
IUPAC Name:
4,8a,9,9-tetramethyldecahydro-1,6-methanonaphthalen-1-ol
Type:
legal entity composition of the substance
State Form:
liquid


Constituent 1
Chemical structure
Reference substance name:
(3S,8S)-2,2,6,8-tetramethyltricyclo[5.3.1.03,8]undecan-3-ol
CAS Number:
21682-90-6
Molecular formula:
C15H26O
IUPAC Name:
(3S,8S)-2,2,6,8-tetramethyltricyclo[5.3.1.03,8]undecan-3-ol
Constituent 2
Chemical structure
Reference substance name:
(3S,3aS,5R)-3,8-dimethyl-5-(prop-1-en-2-yl)-1,2,3,3a,4,5,6,7-octahydroazulene
CAS Number:
3691-11-0
Molecular formula:
C15H24
IUPAC Name:
(3S,3aS,5R)-3,8-dimethyl-5-(prop-1-en-2-yl)-1,2,3,3a,4,5,6,7-octahydroazulene
Constituent 3
Chemical structure
Reference substance name:
1,4-dimethyl-7-(prop-1-en-2-yl)-1,2,3,4,5,6,7,8-octahydroazulene
CAS Number:
3691-12-1
Molecular formula:
C15H24
IUPAC Name:
1,4-dimethyl-7-(prop-1-en-2-yl)-1,2,3,4,5,6,7,8-octahydroazulene
Type:
legal entity composition of the substance
State Form:
liquid


Constituent 1