2-(2-Anilino-2-oxoethoxy)-5-bromobenzoic acid
Basic information
- CAS
18704-96-6- Standard SMILES
O=C(COc1ccc(Br)cc1C(=O)O)Nc1ccccc1- InChIKey
KDDXGTBQGWMQSD-UHFFFAOYSA-N- Molecular formula
- C15H12BrNO4
- Average molar mass
- 350.16 g/mol
- Monoisotopic mass
- 348.99497
Names & identifiers
- Preferred name
- 2-(2-Anilino-2-oxoethoxy)-5-bromobenzoic acid
- IUPAC
- 2-(2-anilino-2-oxoethoxy)-5-bromobenzoic acid
Names & synonyms
18704-96-62-(2-anilino-2-oxoethoxy)-5-bromobenzoic acidNSC211890DTXSID90309397AKOS008970987NSC-211890
Database identifiers
- CAS
18704-96-6- PubChem CID
- 309586
- DTXSID
DTXSID90309397
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
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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