2-(2-Anilino-2-oxoethoxy)-4-chlorobenzoic acid
Basic information
- CAS
18738-17-5- Standard SMILES
O=C(COc1cc(Cl)ccc1C(=O)O)Nc1ccccc1- InChIKey
NHGBFODNUUYJAS-UHFFFAOYSA-N- Molecular formula
- C15H12ClNO4
- Average molar mass
- 305.71 g/mol
- Monoisotopic mass
- 305.0454856
Names & identifiers
- Preferred name
- 2-(2-Anilino-2-oxoethoxy)-4-chlorobenzoic acid
- IUPAC
- 2-(2-anilino-2-oxoethoxy)-4-chlorobenzoic acid
Names & synonyms
18738-17-52-(2-anilino-2-oxoethoxy)-4-chlorobenzoic acidNSC211858DTXSID90309372AKOS008970603NSC-211858
Database identifiers
- CAS
18738-17-5- PubChem CID
- 309558
- DTXSID
DTXSID90309372
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 75.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 371
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Compound notes
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