8-Phenyl-1-octanol

C₁₄H₂₂OCAS 10472-97-6206.33 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₄H₂₂O
Molar mass: 206.33 g/mol
Exact mass: 206.1671 Da
logP: 3.56Crippen estimate
Polar surface area: 20.2 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 8

Hazards

Warning

H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers

Aggregated from 39 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, P362+P364

Identifiers

CAS number

10472-97-6

SMILES

C1=CC=C(C=C1)CCCCCCCCO

InChIKey

MGIGATOGROSKNW-UHFFFAOYSA-N

InChI

InChI=1S/C14H22O/c15-13-9-4-2-1-3-6-10-14-11-7-5-8-12-14/h5,7-8,11-12,15H,1-4,6,9-10,13H2

Weigh it out

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

Names and synonyms

1 names

8-Phenyloctan-1-ol

Work with 8-Phenyl-1-octanol

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

5-Phenyl-1-pentanol10521-91-2100 % similar 6-Phenyl-1-hexanol2430-16-2100 % similar Benzenebutanol3360-41-695 % similar Benzenepropanol122-97-480 % similar Phenethyl alcohol60-12-867 % similar 4-Pyridinebutanol5264-15-360 % similar 1,3-Diphenylpropane1081-75-055 % similar 3-(Benzylamino)propanol4720-29-054 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

3,5-Di-tert-butylphenol1138-52-9 Alpha-isomethyl ionone127-51-5 2,6-Di-tert-butylphenol128-39-2 Methylionone1335-46-2 4-tert-Octylphenol140-66-9 4-N-Octylphenol1806-26-4 Octylphenol27193-28-8 (+-)-Cashmeran33704-61-9

Elsewhere

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