Basic information
- CAS
6628-03-1- Standard SMILES
O=C(Cl)CCCc1ccc(Br)cc1- InChIKey
QMAWCTRRPJNDBJ-UHFFFAOYSA-N- Molecular formula
- C10H10BrClO
- Average molar mass
- 261.54 g/mol
- Monoisotopic mass
- 259.96035472
Names & identifiers
- Preferred name
- 4-(4-Bromophenyl)butanoyl chloride
- IUPAC
- 4-(4-bromophenyl)butanoyl chloride
- English name
- 4-(4-bromophenyl)butanoyl chloride
- Molecular formula
- C10H10BrClO
- Molecular weight
- 261.54
Names & synonyms
4-(4-bromophenyl)butanoyl chloride6628-03-1DTXSID80289316RefChem:287885DTXCID80240462NSC60280SCHEMBL3866365QMAWCTRRPJNDBJ-UHFFFAOYSA-NNSC-602804-(4-bromo-phenyl)-butyryl chloride4-(4-bromophenyl)butyric acid chlorideBenzenebutanoyl chloride, 4-broMo-
Database identifiers
- CAS
6628-03-1- PubChem CID
- 246776
- DTXSID
DTXSID80289316
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 4
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 164
Chemistry & industry
Suppliers1 total
Hangzhou Sage Chemical Co., Ltd.+86057186818502 13588463833 · [email protected]
Related reactions
3 records
Compound notes
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