Registration Dossier

Diss Factsheets

Administrative data

Endpoint:
water solubility
Type of information:
calculation (if not (Q)SAR)
Remarks:
Episuite
Adequacy of study:
key study
Study period:
20-02-2020
Reliability:
1 (reliable without restriction)

Data source

Reference
Reference Type:
other: Modelled data
Title:
Unnamed
Year:
2020
Report date:
2020

Materials and methods

Test guideline
Qualifier:
no guideline required
Principles of method if other than guideline:
WSKOW v1.42
GLP compliance:
no
Type of method:
other: In-silico modelling

Test material

Constituent 1
Chemical structure
Reference substance name:
Glycerol tribenzoate
EC Number:
210-379-6
EC Name:
Glycerol tribenzoate
Cas Number:
614-33-5
Molecular formula:
C24H20O6
IUPAC Name:
1,3-bis(benzoyloxy)propan-2-yl benzoate
Test material form:
solid: flakes
Details on test material:
room temperature: off-white coloured flakes or granulate; > 80 °C: colourless to yellowish liquid
Batch no. 20118
CAS no. 614-33-5
Production date 28. Jul. 2020
Expiry date 15. Aug. 2022

Results and discussion

Water solubility
Key result
Water solubility:
0.263 mg/L
Temp.:
25 °C
pH:
7

Applicant's summary and conclusion