Registration Dossier
Registration Dossier
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EC number: 700-336-4 | CAS number: 1141-23-7
Partition coefficient
Administrative data
- Endpoint:
- partition coefficient
- Type of information:
- experimental study
- Adequacy of study:
- key study
- Study period:
- 2008
- Reliability:
- 1 (reliable without restriction)
- Rationale for reliability incl. deficiencies:
- other: quality controlled study
Data source
Reference
- Reference Type:
- study report
- Title:
- Unnamed
- Year:
- 2 008
Materials and methods
- Principles of method if other than guideline:
- partition coeficient calculated by dividing the solubility in n-octanol by the solubility in water
- GLP compliance:
- not specified
- Type of method:
- other: partition coeficient calculated by dividing the solubility in n-octanol by the solubility in water
- Partition coefficient type:
- octanol-water
Test material
- Reference substance name:
- (3R)-4-carbamoyl-3-(4-chlorophenyl)butanoic acid; (3S)-4-carbamoyl-3-(4-chlorophenyl)butanoic acid
- EC Number:
- 700-336-4
- Cas Number:
- 1141-23-7
- Molecular formula:
- C11H12ClNO3
- IUPAC Name:
- (3R)-4-carbamoyl-3-(4-chlorophenyl)butanoic acid; (3S)-4-carbamoyl-3-(4-chlorophenyl)butanoic acid
- Reference substance name:
- 5-amino-3-(4-chlorophenyl)-5-oxopentanoic acid
- IUPAC Name:
- 5-amino-3-(4-chlorophenyl)-5-oxopentanoic acid
Constituent 1
Constituent 2
Results and discussion
Partition coefficient
- Type:
- Pow
- Partition coefficient:
- 4
- Temp.:
- 25 °C
- pH:
- ca. 6
Applicant's summary and conclusion
- Executive summary:
The Pow (particient coefficient n-octanol/ water) of 5-amino-3-(4-chlorophenyl)-5-oxopentanoic acid is 4.
Pow= 4
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