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Please be aware that this old REACH registration data factsheet is no longer maintained; it remains frozen as of 19th May 2023.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
Reliability:
1 (reliable without restriction)
Rationale for reliability incl. deficiencies:
guideline study

Data source

Reference
Reference Type:
study report
Title:
Unnamed
Year:
2020
Report date:
2020

Materials and methods

Test guideline
Qualifier:
according to guideline
Guideline:
OECD Guideline 105 (Water Solubility)
Deviations:
no
GLP compliance:
yes (incl. QA statement)
Type of method:
flask method

Test material

Constituent 1
Reference substance name:
Santalene oil: fermentation products of glucose with santalene synthase modified Rhodobacter sphaeroides, distilled
EC Number:
950-969-7
Molecular formula:
not applicable
IUPAC Name:
Santalene oil: fermentation products of glucose with santalene synthase modified Rhodobacter sphaeroides, distilled
Test material form:
liquid

Results and discussion

Water solubilityopen allclose all
Key result
Water solubility:
6.3 mg/L
Conc. based on:
test mat.
Loading of aqueous phase:
1 g/L
Temp.:
20 °C
pH:
>= 5.5 - <= 6
Key result
Water solubility:
39.2 mg/L
Conc. based on:
test mat.
Loading of aqueous phase:
10 g/L
Temp.:
20 °C
pH:
>= 5.5 - <= 6

Any other information on results incl. tables

The solubility in water is not a constant but increases with the mass of test item applied in the experiment. This is because the

test item is a mixture. Every constituent contributes to a different degree to overall solubility, depending on its own individual solubility

and its mass fraction in the test item. Therefore, results depend on the proportions of test item and water used in the respective

experiment.

The measured values are higher (100-1000 times) than the theoretically calculated values.

(Beta Santalene, CAS: 511 -59 -1; 0.02577 mg/l at 25 °C, estimated from Kow WSKOW v. 1.42)

(Alpha Santalene, CAS: 512 -61-8; 0.02577 mg/l at 25 °C, estimated from Kow WSKOW v. 1.42)

lt may be possible that the measured values are the result of overestimation of the aqueous concentration due to formation of

microdroplets of test item in the aqueous phase.

Applicant's summary and conclusion