(3-Bromoanilino) acetate
Basic information
- CAS
114838-63-0- Standard SMILES
CC(=O)ONc1cccc(Br)c1- InChIKey
CELOWHWVIPXNSU-UHFFFAOYSA-N- Molecular formula
- C8H8BrNO2
- Average molar mass
- 230.06 g/mol
- Monoisotopic mass
- 228.97384
Names & identifiers
- Preferred name
- (3-Bromoanilino) acetate
- IUPAC
- (3-bromoanilino) acetate
Names & synonyms
(3-bromoanilino) acetate114838-63-0DTXSID601508781-[(3-Bromoanilino)oxy]ethan-1-one
Database identifiers
- CAS
114838-63-0- PubChem CID
- 189253
- DTXSID
DTXSID60150878
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 38.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 163
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Related reactions
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Compound notes
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