Basic information
- CAS
79044-18-1- Standard SMILES
CC(Br)CCc1ccccc1Br- InChIKey
HYWRPIJHKISWPQ-UHFFFAOYSA-N- Molecular formula
- C10H12Br2
- Average molar mass
- 292.01 g/mol
- Monoisotopic mass
- 289.93058
Names & identifiers
- Preferred name
- 1-Bromo-2-(3-bromobutyl)benzene
- IUPAC
- 1-bromo-2-(3-bromobutyl)benzene
Names & synonyms
79044-18-11-bromo-2-(3-bromobutyl)benzeneNSC338431DTXSID80319001AKOS011003136NSC-338431
Database identifiers
- CAS
79044-18-1- PubChem CID
- 334097
- DTXSID
DTXSID80319001
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 3
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 125
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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