1-Phenyl-1-pentanol

C₁₁H₁₆OCAS 583-03-9164.25 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₁H₁₆O
Molar mass: 164.25 g/mol
Exact mass: 164.1201 Da
Density: 0.966 g/mL (at 24 °C)
Melting point: below 25 °C
Boiling point: 123.5 °C
logP: 2.91Crippen estimate
Polar surface area: 20.2 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 4

Hazards

Warning

H319 Causes serious eye irritation100% of notifiers
H400 Very toxic to aquatic life100% of notifiers

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

Precautionary statements

P264+P265, P273, P280, P305+P351+P338, P337+P317, P391, P501

Identifiers

CAS number

583-03-9

SMILES

CCCCC(O)c1ccccc1

InChIKey

OVGORFFCBUIFIA-UHFFFAOYSA-N

InChI

InChI=1S/C11H16O/c1-2-3-9-11(12)10-7-5-4-6-8-10/h4-8,11-12H,2-3,9H2,1H3

Weigh it out

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

Names and synonyms

16 names · show all

Benzenemethanol, α-butyl-
Benzyl alcohol, α-butyl-
α-Butylbenzenemethanol
1-Pentanol, 1-phenyl-
1-Phenylpentanol
1-Phenyl-1-hydroxy-n-pentane
Fenipentol
α-Butylbenzyl alcohol
Phenylbutylcarbinol
Pancoral
1-Phenyl-1-hydroxypentane
(±)-1-Phenyl-1-pentanol
(±)-α-Butylbenzyl alcohol
Ph BC
PC 1
NSC 8478

Work with 1-Phenyl-1-pentanol

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

1,1-Diphenylpentane1726-12-162 % similar (+)-1-Phenyl-1-propanol1565-74-859 % similar (S)-1-Phenylpropanol613-87-659 % similar 1-Phenyl-1-propanol93-54-959 % similar (1R)-3-Chloro-1-phenyl-propan-1-ol100306-33-055 % similar (-)-3-Chloro-1-phenyl-1-propanol100306-34-155 % similar 1,1'-Hexylidenebis(benzene)1530-04-755 % similar 3-Chloro-1-phenyl-1-propanol18776-12-055 % similar

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

Same formula

2-Methyl-4-phenyl-2-butanol103-05-9 5-Phenyl-1-pentanol10521-91-2 4-Pentylphenol14938-35-3 1-Adamantanecarboxaldehyde2094-74-8 2-tert-Butyl-6-methylphenol2219-82-1 2-tert-Butyl-4-methylphenol2409-55-4 Jasmone488-10-8 4-tert-Butylanisole5396-38-3

Elsewhere

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