Registration Dossier

Administrative data

Endpoint:
water solubility
Type of information:
calculation (if not (Q)SAR)
Adequacy of study:
key study
Reliability:
2 (reliable with restrictions)
Rationale for reliability incl. deficiencies:
accepted calculation method
Justification for type of information:
Calculation was performed with EPI Suite, WSKOW v1.42 which is an accepted program for the calculation of this endpoint.

Data source

Reference
Reference Type:
other: Calculation
Title:
Unnamed
Year:
2018

Materials and methods

Test guideline
Qualifier:
no guideline required
Principles of method if other than guideline:
Calculation was performed with EPI Suite, WSKOW v1.42 which is an accepted program for the calculation of this endpoint.
GLP compliance:
no

Test material

Constituent 1
Chemical structure
Reference substance name:
α-methyl-1H-imidazole-1-ethanol
EC Number:
253-668-2
EC Name:
α-methyl-1H-imidazole-1-ethanol
Cas Number:
37788-55-9
Molecular formula:
C6H10N2O
IUPAC Name:
1-(1H-imidazol-1-yl)propan-2-ol
Test material form:
other: liquid

Results and discussion

Water solubility
Key result
Water solubility:
224 g/L
Conc. based on:
test mat.
Temp.:
25 °C
pH:
7

Applicant's summary and conclusion

Conclusions:
The partition coefficient calculated with EPI Suite, WSKOW v1.42 was determined to be 224 g/l.