5-(2-Bromoacetyl)-2-hydroxybenzoic acid
Basic information
- CAS
62423-71-6- Standard SMILES
O=C(CBr)c1ccc(O)c(C(=O)O)c1- InChIKey
AWCZHDQYNKDRCC-UHFFFAOYSA-N- Molecular formula
- C9H7BrO4
- Average molar mass
- 259.05 g/mol
- Monoisotopic mass
- 257.95277
Names & identifiers
- Preferred name
- 5-(2-Bromoacetyl)-2-hydroxybenzoic acid
- IUPAC
- 5-(2-bromoacetyl)-2-hydroxybenzoic acid
- English name
- 5-(2-bromoacetyl)-2-hydroxy-benzoic acid
- Molecular formula
- C9H7BrO4
- Molecular weight
- 259.05
Names & synonyms
62423-71-65-(2-bromoacetyl)-2-hydroxybenzoic acid5-(Bromoacetyl)-2-hydroxybenzoic acid5-(2-bromoacetyl)-2-hydroxy-benzoic acidNSC81062Benzoic acid, 5-(bromoacetyl)-2-hydroxy-Salbutamol Impurity 114SCHEMBL3947199DTXSID40292240AWCZHDQYNKDRCC-UHFFFAOYSA-NNSC-81062AKOS025296142
Show more names
Salbutamol Impurity 55Benzoic acid, 5-(2-bromoacetyl)-2-hydroxy-
2-hydroxy-5-(2-bromoacetyl)benzoic acid2-hydroxy-5-(alpha-bromoacetyl) benzoic acid
Database identifiers
- CAS
62423-71-6- PubChem CID
- 255478
- DTXSID
DTXSID40292240- Nikkaji
- J852.764D
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 74.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 241
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Related reactions
2 records
Compound notes
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