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Please be aware that this old REACH registration data factsheet is no longer maintained; it remains frozen as of 19th May 2023.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

Administrative data

Endpoint:
water solubility
Type of information:
experimental study
Adequacy of study:
key study
Study period:
July 2015
Reliability:
1 (reliable without restriction)
Rationale for reliability incl. deficiencies:
other: Study done to guideline, in compliance with GLP.

Data source

Reference
Reference Type:
study report
Title:
Unnamed
Year:
2015
Report date:
2015

Materials and methods

Test guidelineopen allclose all
Qualifier:
according to guideline
Guideline:
OECD Guideline 105 (Water Solubility)
Deviations:
no
Qualifier:
according to guideline
Guideline:
EU Method A.6 (Water Solubility)
Deviations:
no
Qualifier:
according to guideline
Guideline:
EPA OPPTS 830.7840 (Water Solubility)
Deviations:
no
GLP compliance:
yes (incl. QA statement)
Type of method:
flask method

Test material

Constituent 1
Chemical structure
Reference substance name:
Tetrahydro-3-pentyl-2H-pyran-4-yl acetate
EC Number:
242-640-5
EC Name:
Tetrahydro-3-pentyl-2H-pyran-4-yl acetate
Cas Number:
18871-14-2
Molecular formula:
C12H22O3
IUPAC Name:
3-O-acetyl-1,5-anhydro-2,4-dideoxy-2-pentylpentitol
Constituent 2
Chemical structure
Reference substance name:
Nonane-1,3-diyl diacetate
EC Number:
264-060-1
EC Name:
Nonane-1,3-diyl diacetate
Cas Number:
63270-14-4
Molecular formula:
C13H24O4
IUPAC Name:
nonane-1,3-diyl diacetate
impurity 1
Chemical structure
Reference substance name:
1-(tetrahydrofuran-3-yl)hexyl acetate
Molecular formula:
C12H22O3
IUPAC Name:
1-(tetrahydrofuran-3-yl)hexyl acetate
impurity 2
Chemical structure
Reference substance name:
rel-(3R,4R)-3-pentyltetrahydro-2H-pyran-4-ol
Cas Number:
24646-98-8
Molecular formula:
C10H20O2
IUPAC Name:
rel-(3R,4R)-3-pentyltetrahydro-2H-pyran-4-ol
impurity 3
Chemical structure
Reference substance name:
3-hydroxynonyl acetate
Cas Number:
902270-36-4
Molecular formula:
C11H22O3
IUPAC Name:
3-hydroxynonyl acetate
Test material form:
liquid

Results and discussion

Water solubility
Water solubility:
0.437 g/L
Temp.:
20 °C
pH:
>= 7.5 - <= 7.6

Applicant's summary and conclusion

Conclusions:
Interpretation of results (migrated information): moderately soluble (100-1000 mg/L)
Executive summary:

The flask method was applied for the determination of the water solubility of Jasmonyl.

The water solubility of the test substance at 20°C was 0.437 g/l (437 mg/l).

The pH of the aqueous samples was 7.5 – 7.6.