Basic information
- CAS
866314-49-0- Standard SMILES
C=C(C)c1ccccc1CCl- InChIKey
GINDJOKFJZFTAX-UHFFFAOYSA-N- Molecular formula
- C10H11Cl
- Average molar mass
- 166.65 g/mol
- Monoisotopic mass
- 166.05492803
Names & identifiers
- Preferred name
- Benzene, 1-(chloromethyl)-2-(1-methylethenyl)-
- IUPAC
- 1-(chloromethyl)-2-prop-1-en-2-ylbenzene
Names & synonyms
866314-49-0Benzene, 1-(chloromethyl)-2-(1-methylethenyl)-chloromethylisopropenylbenzene1-(CHLOROMETHYL)-2-(PROP-1-EN-2-YL)BENZENESCHEMBL7939440DTXSID60467478GINDJOKFJZFTAX-UHFFFAOYSA-NAKOS006382916
Database identifiers
- CAS
866314-49-0- PubChem CID
- 11491997
- DTXSID
DTXSID60467478- Nikkaji
- J3.005.355I
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 2
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 140
Related reactions
2 records
Compound notes
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