(1-Chloro-3-methylbutan-2-yl)benzene
Basic information
- CAS
5285-30-3- Standard SMILES
CC(C)C(CCl)c1ccccc1- InChIKey
AXBNMPTWUWEFAH-UHFFFAOYSA-N- Molecular formula
- C11H15Cl
- Average molar mass
- 182.69 g/mol
- Monoisotopic mass
- 182.0862282
Names & identifiers
- Preferred name
- (1-Chloro-3-methylbutan-2-yl)benzene
- IUPAC
- (1-chloro-3-methylbutan-2-yl)benzene
Names & synonyms
(1-chloro-3-methylbutan-2-yl)benzene5285-30-3Benzene, [1-(chloromethyl)-2-methylpropyl]SCHEMBL3126772DTXSID60335284AXBNMPTWUWEFAH-UHFFFAOYSA-NAKOS014315687(2-methyl-1-chloromethylpropyl)benzene[1-(chloromethyl)-2-methyl-propyl]benzeneDS-019436CS-0273481EN300-676449
Database identifiers
- CAS
5285-30-3- PubChem CID
- 524324
- DTXSID
DTXSID60335284
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 3
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 114
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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