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Diss Factsheets

Physical & Chemical properties

Water solubility

Currently viewing:

Administrative data

Endpoint:
water solubility
Type of information:
experimental study
Adequacy of study:
key study
Study period:
03 July 2018 - 12 October 2018
Reliability:
1 (reliable without restriction)
Rationale for reliability incl. deficiencies:
guideline study
Cross-reference
Reason / purpose for cross-reference:
reference to other study

Data source

Reference
Reference Type:
study report
Title:
Unnamed
Year:
2019

Materials and methods

Test guidelineopen allclose all
Qualifier:
according to guideline
Guideline:
EU Method A.6 (Water Solubility)
Version / remarks:
2016
Deviations:
no
Qualifier:
according to guideline
Guideline:
OECD Guideline 105 (Water Solubility)
Version / remarks:
1995
Deviations:
no
Qualifier:
according to guideline
Guideline:
EPA OPPTS 830.7840 (Water Solubility)
Version / remarks:
1998
Deviations:
no
GLP compliance:
yes
Type of method:
flask method

Test material

Constituent 1
Chemical structure
Reference substance name:
{2-[(2R)-4-methyl-2-phenylpiperazin-1-yl]pyridin-3-yl}methanol; {2-[(2S)-4-methyl-2-phenylpiperazin-1-yl]pyridin-3-yl}methanol
EC Number:
700-296-8
Cas Number:
61337-89-1
Molecular formula:
C17-H21-N3-O
IUPAC Name:
{2-[(2R)-4-methyl-2-phenylpiperazin-1-yl]pyridin-3-yl}methanol; {2-[(2S)-4-methyl-2-phenylpiperazin-1-yl]pyridin-3-yl}methanol
Test material form:
solid: particulate/powder
Details on test material:
Physical appearance: white powder
Storage conditions: at room temperature

Results and discussion

Water solubility
Key result
Water solubility:
2.63 g/L
Conc. based on:
test mat.
Loading of aqueous phase:
14 g/L
Incubation duration:
>= 24 - <= 72 h
Temp.:
20 °C
pH:
9.3
Remarks on result:
other: mean of concentrations measured at all 3 sampling occasions
Details on results:
- No test item was detected in the pretreated sample from the blank water mixture.
- Concentration analysed after 24, 48 and 72 hours of stirring: 2.64 g/L, 2.62 g/L and 2.63 g/L, resp.
- Maximum difference meets the criterion of ≤ 15% (i.e. 0.66%)
- The mean of the three concentrations measured at 24, 48 and 72 hours was reported as the water solubility of the substance.

Applicant's summary and conclusion

Conclusions:
The water solubility of the substance at 20°C was determined to be 2.63 g/L (flask method).