chempirical

2-Cyclohexylphenol

C12H16OCAS 119-42-6176.26 g/mol

Open in Covalent MOL file
OH
Phenol

Properties

Molecular formula
C12H16O
Molar mass
176.26 g/mol
Exact mass
176.1201 Da
Melting point
66–67 °C
Boiling point
150–151 °C
logP
3.44Crippen estimate
Polar surface area
20.2 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
1

Identifiers

CAS number
119-42-6
SMILES
Oc1ccccc1C1CCCCC1
InChIKey
MVRPPTGLVPEMPI-UHFFFAOYSA-N
InChI
InChI=1S/C12H16O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h4-5,8-10,13H,1-3,6-7H2

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

4 names
  • Phenol, 2-cyclohexyl-
  • Phenol, o-cyclohexyl-
  • o-Cyclohexylphenol
  • NSC 6093

Work with 2-Cyclohexylphenol

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Similar compounds

2-Cyclohexylbenzaldehyde128323-04-648 % similar 2-Isopropylphenol88-69-748 % similar O-sec-Butylphenol89-72-545 % similar Catechol120-80-942 % similar 1,4-Dicyclohexylbenzene1087-02-141 % similar Eddha1170-02-139 % similar 1-Cyclopropylnaphthalene25033-19-638 % similar Cyclohexyldiphenylphosphine6372-42-538 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

1-(1,1-Dimethylethoxy)-3-ethenylbenzene105612-79-1 4-Cyclohexylphenol1131-60-8 1-[2-Methyl-5-(1-methylethyl)phenyl]ethanone1202-08-0 1-Phenylcyclohexanol1589-60-2 1-(4-Methylphenyl)-1-pentanone1671-77-8 Pentamethylbenzaldehyde17432-38-1 1-Phenyl-2-hexanone25870-62-6 1-Phenyl-3-hexanone29898-25-7

Elsewhere

PubChem CAS Common Chemistry NIST WebBook