chempirical

2-Cyclohexyl-5-methylphenol

C13H18OCAS 1596-13-0190.29 g/mol

Open in Covalent MOL file
OH
Phenol

Properties

Molecular formula
C13H18O
Molar mass
190.29 g/mol
Exact mass
190.1358 Da
logP
3.75Crippen estimate
Polar surface area
20.2 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
1

Identifiers

CAS number
1596-13-0
SMILES
CC1=CC(=C(C=C1)C2CCCCC2)O
InChIKey
SRGATTGYDONWOU-UHFFFAOYSA-N
InChI
InChI=1S/C13H18O/c1-10-7-8-12(13(14)9-10)11-5-3-2-4-6-11/h7-9,11,14H,2-6H2,1H3

Weigh it out

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

Work with 2-Cyclohexyl-5-methylphenol

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 Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Thymol89-83-858 % similar 2-Cyclohexylphenol119-42-655 % similar 2,2′-Methylenebis(4-methyl-6-cyclohexylphenol)4066-02-849 % similar 4-Methylcatechol452-86-848 % similar 2,5-Dimethylphenol95-87-445 % similar 2-Amino-5-methylphenol2835-98-543 % similar 2-Chloro-5-methylphenol615-74-743 % similar Amylmetacresol1300-94-343 % similar

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

Same formula

Cyclamen aldehyde103-95-7 2,3-Dihydro-2,2,4,6,7-pentamethylbenzofuran142874-81-5 Heptanophenone1671-75-6 Bourgeonal18127-01-0 1-(2,3,4,5,6-Pentamethylphenyl)ethanone2040-01-9 1-(2,6,6-Trimethyl-1,3-cyclohexadien-1-yl)-2-buten-1-one23696-85-7 1-(4-Pentylphenyl)ethanone37593-02-5 Spiro[5.7]trideca-1,4-dien-3-one41138-71-0

Elsewhere

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