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Please be aware that this old REACH registration data factsheet is no longer maintained; it remains frozen as of 19th May 2023.

The new ECHA CHEM database has been released by ECHA, and it now contains all REACH registration data. There are more details on the transition of ECHA's published data to ECHA CHEM here.

Diss Factsheets

Reference substances

Reference substances

Currently viewing:
IUPAC name:
Fatty acids, C18-unsatd., dimers, 2-ethylhexyl esters

Inventory

EC number:
500-204-4
EC name:
Fatty acids, C18-unsatd., dimers, 2-ethylhexyl esters
CAS number:
68334-05-4
CAS number:
68334-05-4
Synonyms
Names:
Identifier:
EC number
500-204-4
Identifier:
IUPAC name
19-[(2-ethylhexyl)oxy]-9-[(3Z)-non-3-en-1-yl]-10-octyl-19-oxononadecanoic acid 9-[(3Z)-non-3-en-1-yl]-10-octylnonadecanedioic acid 1,19-bis(2-ethylhexyl) 9-[(3Z)-non-3-en-1-yl]-10-octylnonadecanedioate
Identifier:
IUPAC name
19-[(2-ethylhexyl)oxy]-9-[(3Z)-non-3-en-1-yl]-10-octyl-19-oxononadecanoic acid 9-[(3Z)-non-3-en-1-yl]-10-octylnonadecanedioic acid 1,19-bis(2-ethylhexyl) 9-[(3Z)-non-3-en-1-yl]-10-octylnonadecanedioate
Identifier:
IUPAC name
500-204-4
Identifier:
IUPAC name
68334-05-4
Identifier:
IUPAC name
Fatty acids, C18-unsatd., dimers, 2-ethylhexyl esters
Identifier:
other: InChl
Not applicable for UVCB substance
Identifier:
other: Molecular formula
As it is an UVCB there is no specific molecular formula
Identifier:
other: Molecular formula
C52H96O4
Identifier:
other: InChl
Example for InChI: InChI=1/C44H80O4/c1-5-9-12-17-24-31-41-39(29-22-13-10-6-2)35-36-40(42(41)32-25-19-14-15-20-26-33-43(45)46)30-23-18-16-21-27-34-44(47)48-37-38(8-4)28-11-7-3/h24,31,35-36,38-42H,5-23,25-30,32-34,37H2,1-4H3,(H,45,46)/b31-24+
Identifier:
other: SMILES notation
Example for SMILES code: CCCCC(CC)COC(=O)CCCCCCCC1C(CCCCCCCCC(O)=O)C(C=CCCCCC)C(CCCCCC)C=C1
Identifier:
other: SMILES notation
Example for SMILES code:CCCCC(CC)COC(=O)CCCCCCCC1C(CCCCCCCCC(O)=O)C(C=CCCCCC)C(CCCCCC)C=C1
Identifier:
other:
Fatty acids, C18-unsatd., dimers, 2-ethylhexyl esters
Identifier:
other: SMILES notation
Not available - UVCB substance
Identifier:
other: InChl
Not available - UVCB substance
Identifier:
other: Molecular formula
UVCB substance no specific molecualr or structural formulae available
Identifier:
other: Molecular formula
non applicable (UVCB)

Molecular and structural information

Molecular formula:
C44H80O4
Molecular weight:
673.1
SMILES notation:
Not applicable for UVCB substance
InChl:
Not applicable for UVCB substance
Structural formula:
Chemical structure

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