Basic information
- CAS
226881-06-7- Standard SMILES
O=C(O)C1CCN(c2ccc(Cl)cc2)C1=O- InChIKey
ANLNOUYHIMXGKJ-UHFFFAOYSA-N- Molecular formula
- C11H10ClNO3
- Average molar mass
- 239.65 g/mol
- Monoisotopic mass
- 239.03492086
Overview
See other relationships...
Names & identifiers
- Preferred name
- 1-(4-Chlorophenyl)-2-oxopyrrolidine-3-carboxylic acid
- IUPAC
- 1-(4-chlorophenyl)-2-oxopyrrolidine-3-carboxylic acid
- English name
- 1-(4-Chlorophenyl)-2-oxopyrrolidine-3-carboxylic acid
- Molecular formula
- C11H10ClNO3
- Molecular weight
- 239.65
Names & synonyms
1-(4-chlorophenyl)-2-oxopyrrolidine-3-carboxylic acid226881-06-7SCHEMBL8921801-(4-chlorophenyl)-2-oxo-pyrrolidine-3-carboxylic Acid3-Pyrrolidinecarboxylicacid, 1-(4-chlorophenyl)-2-oxo-DTXSID00398853ANLNOUYHIMXGKJ-UHFFFAOYSA-NAKOS000167745AKOS022203215DB-031563CS-0251011EN300-53179
Show more names
3-Pyrrolidinecarboxylic acid, 1-(4-chlorophenyl)-2-oxo-JR-6455, 1-(4-Chlorophenyl)-2-oxopyrrolidine-3-carboxylic acid, 97%
1-(4-chlorophenyl)-3-carboxy-2-pyrrolidinoneG415331-(4-chlorophenyl)-2-oxopyrrolidine-3-carboxylicacidZ285921864
Database identifiers
- CAS
226881-06-7- PubChem CID
- 4057084
- DTXSID
DTXSID00398853- Nikkaji
- J2.138.086E
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 57.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 300
Physicochemical properties
- Symbol(GHS)
- 6 · GHS06
- Signal word
- Danger
- Hazard statements
- 335 · H335-H319-H301-H315
- Precautionary statements
- 264 · P264-P270-P301+P310-P321-P330-P405-P501-P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Danger
- Symbol(GHS)
- GHS06
- Hazard statements
- H335-H319-H301-H315
- Precautionary statements
- P264-P270-P301+P310-P321-P330-P405-P501-P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
Chemistry & industry
Suppliers5 total
无锡丽恒昇生物医药科技有限公司15250805028 15250805028 · [email protected]
砌块化学科技（上海）有限公司021-20432219 13918097649 · [email protected]
烟台盛凯伦化学科技有限公司13356901049 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 17714375163 · [email protected]
济南思考化学有限公司0531-0000 · [email protected]
Related reactions
8 records
Compound notes
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