(3R)-5-oxo-1-[(1S)-1-phenylethyl]pyrrolidine-3-carboxylic acid
Basic information
- CAS
146348-15-4- Standard SMILES
C[C@@H](c1ccccc1)N1C[C@H](C(=O)O)CC1=O- InChIKey
CFGKWSDAMXTRHE-GXSJLCMTSA-N- Molecular formula
- C13H15NO3
- Average molar mass
- 233.26 g/mol
- Monoisotopic mass
- 233.10519334
Names & identifiers
- Preferred name
- (3R)-5-oxo-1-[(1S)-1-phenylethyl]pyrrolidine-3-carboxylic acid
- IUPAC
- (3R)-5-oxo-1-[(1S)-1-phenylethyl]pyrrolidine-3-carboxylic acid
Names & synonyms
146348-15-4(3R)-5-oxo-1-[(1S)-1-phenylethyl]pyrrolidine-3-carboxylic acid(3R)-5-oxo-1-((1S)-1-phenylethyl)pyrrolidine-3-carboxylic acidRefChem:400983971-005-1(R)-5-Oxo-1-((S)-1-phenylethyl)pyrrolidine-3-carboxylic acid(R)-5-Oxo-1-[(S)-1-phenylethyl]pyrrolidine-3-carboxylic Acidstarbld0011881SCHEMBL12316010MFCD30537407SY273883EN300-266696
Show more names
F71071SR-01000306814SR-01000306814-1(3R)-5-oxo-1-[(1S)-1-phenylethyl]pyrrolidine-3-carboxylicacid
Database identifiers
- CAS
146348-15-4- PubChem CID
- 723633
- EC Number
- 971-005-1
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 57.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 310
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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