Basic information
- CAS
61653-12-1- Standard SMILES
CCC(C)CC(C)Br- InChIKey
NRWCWVSNXYGJCU-UHFFFAOYSA-N- Molecular formula
- C7H15Br
- Average molar mass
- 179.1 g/mol
- Monoisotopic mass
- 178.03571
Names & identifiers
- Preferred name
- 2-Bromo-4-methylhexane
- IUPAC
- 2-bromo-4-methylhexane
Names & synonyms
2-BROMO-4-METHYLHEXANE61653-12-1DTXSID40567263RefChem:1062462DTXCID80518037(+)-2-bromo-4-methylhexaneAKOS014047441EN300-1896958
Database identifiers
- CAS
61653-12-1- PubChem CID
- 15033596
- DTXSID
DTXSID40567263
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 3
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 52.3
Experimental & physicochemical properties
SpringerMaterials PropertiesDensity
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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