(2R,4S)-4-Acetoxypyrrolidine-2-carboxylic acid
Basic information
- CAS
142796-93-8- Standard SMILES
CC(=O)O[C@@H]1CN[C@@H](C(=O)O)C1- InChIKey
OQWHXHYZFMIILA-NTSWFWBYSA-N- Molecular formula
- C7H11NO4
- Average molar mass
- 173.17 g/mol
Names & identifiers
- Preferred name
- (2R,4S)-4-Acetoxypyrrolidine-2-carboxylic acid
- IUPAC
- (2R,4S)-4-acetyloxypyrrolidine-2-carboxylic acid
- English name
- D-Proline, 4-(acetyloxy)-, trans- (9CI)
- Molecular formula
- C7H11NO4
- Molecular weight
- 173.16654
Names & synonyms
142796-93-8(2R,4S)-4-Acetoxypyrrolidine-2-carboxylic acid(2R,4S)-4-Acetoxy-D-prolineD-Proline, 4-(acetyloxy)-, trans- (9CI)(2R,4S)-4-acetyloxypyrrolidine-2-carboxylic acidMFCD27944708SY374458(2R,4S)-4-(acetyloxy)pyrrolidine-2-carboxylic acid
Database identifiers
- CAS
142796-93-8
Properties
Computed structural properties
- XLogP
- -2.8
- Topological polar surface area
- 75.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 204
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