Basic information
- Standard SMILES
CCCCC1=C(C)CCCC1(C)C- InChIKey
GYFOADHQXSZNPW-UHFFFAOYSA-N- Molecular formula
- C13H24
- Average molar mass
- 180.33 g/mol
Names & identifiers
- Preferred name
- Cyclohexene, 2-butyl-1,3,3-trimethyl-
- IUPAC
- 2-butyl-1,3,3-trimethylcyclohexene
Names & synonyms
SCHEMBL3186206SCHEMBL104249242-butyl-1,3,3-trimethyl-cyclohexeneCyclohexene, 2-butyl-1,3,3-trimethyl-2-Butyl-1,3,3-trimethyl-1-cyclohexene #1,3,3-trimethyl-2-(but-1-yl)-cyclohex-1-ene
Database identifiers
- PubChem CID
- 596705
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 3
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 196
Experimental & physicochemical properties
SpringerMaterials PropertiesOptical coefficient
Related reactions
1 records
Compound notes
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