1-Phenylcyclohexene
Properties
- Molecular formula
- C12H14
- Molar mass
- 158.24 g/mol
- Exact mass
- 158.1096 Da
- Density
- 1.004 g/mL (at 0 °C)
- Boiling point
- 133 °C (at 20 Torr)
- logP
- 3.64Crippen estimate
- Polar surface area
- 0.0 Ų
- H-bond donors / acceptors
- 0 / 0
- Rotatable bonds
- 1
Hazards
Warning
- H302 Harmful if swallowed100% of notifiers
- H315 Causes skin irritation100% of notifiers
- H319 Causes serious eye irritation100% of notifiers
- H335 May cause respiratory irritation100% of notifiers
Aggregated from the ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501
Identifiers
CAS number
31017-40-0SMILES
C1CCC(=CC1)C2=CC=CC=C2InChIKey
WCMSFBRREKZZFL-UHFFFAOYSA-NInChI
InChI=1S/C12H14/c1-3-7-11(8-4-1)12-9-5-2-6-10-12/h1,3-4,7-9H,2,5-6,10H2Weigh it out
Type any one amount. The others follow from the molar mass and density.
Names and synonyms
5 names
- Cyclohexen-1-ylbenzene
- Benzene, cyclohexen-1-yl-
- Benzene, cyclohexenyl-
- Phenylcyclohexene
- Cyclohexenylbenzene
Work with 1-Phenylcyclohexene
Stereoisomers, salts and isotopologues
The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.
Similar compounds
1,2,3,6-Tetrahydro-4-phenylpyridine10338-69-950 % similar
1,6-Diphenyl-1,6-hexanedione3375-38-048 % similar
4-Phenyl-1,2,5,6-tetrahydropyridine hydrochloride43064-12-646 % similar
1-Methyl-4-phenyl-1,2,3,6-tetrahydropyridine hydrochloride23007-85-442 % similar
1,4-Diphenyl-1,4-butanedione495-71-641 % similar
Hexanophenone942-92-740 % similar
Heptanophenone1671-75-639 % similar
Octanophenone1674-37-939 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.