Basic information
- Standard SMILES
CC(=O)Nc1ccc(CC(=O)O)cc1Cl- InChIKey
UUPITOKULSDXIO-UHFFFAOYSA-N- Molecular formula
- C10H10ClNO3
- Average molar mass
- 227.64 g/mol
Names & identifiers
- Preferred name
- 2-(3-Chloro-4-acetamidophenyl)acetic acid
- IUPAC
- 2-(4-acetamido-3-chlorophenyl)acetic acid
Names & synonyms
59235-32-42-(3-chloro-4-acetamidophenyl)acetic acid4-(acetylamino)-3-chloroBenzeneacetic acidSCHEMBL1285674SCHEMBL11801468UUPITOKULSDXIO-UHFFFAOYSA-N3-chloro-4-acetamidophenylacetic acid(4-Acetamido-3-chlorophenyl)acetic AcidDB-218468EN300-9845661
Database identifiers
- PubChem CID
- 18701947
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 66.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 257
Related reactions
4 records
Linked notes
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