4-(Phenylmethoxy)benzeneethanol

C₁₅H₁₆O₂CAS 61439-59-6228.29 g/mol

Open in Covalent MOL file

Alcohol Ether

Properties

Molecular formula: C₁₅H₁₆O₂
Molar mass: 228.29 g/mol
Exact mass: 228.1150 Da
Melting point: 87–88 °C
logP: 2.80Crippen estimate
Polar surface area: 29.5 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 5

Hazards

Warning

H315 Causes skin irritation22.2% of notifiers
H317 May cause an allergic skin reaction11.1% of notifiers
H319 Causes serious eye irritation33.3% of notifiers
H335 May cause respiratory irritation22.2% of notifiers
H412 Harmful to aquatic life with long lasting effects11.1% of notifiers

Aggregated from 9 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P272, P273, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P333+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

61439-59-6

SMILES

OCCc1ccc(OCc2ccccc2)cc1

InChIKey

JCUJAHLWCDISCC-UHFFFAOYSA-N

InChI

InChI=1S/C15H16O2/c16-11-10-13-6-8-15(9-7-13)17-12-14-4-2-1-3-5-14/h1-9,16H,10-12H2

Weigh it out

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

Names and synonyms

10 names

Benzeneethanol, 4-(phenylmethoxy)-
p-(Benzyloxy)phenethyl alcohol
2-(p-Benzyloxyphenyl)ethanol
2-(4-Benzyloxyphenyl)ethanol
β-(p-Benzyloxyphenyl)ethyl alcohol
4-Benzyloxyphenethyl alcohol
2-(4(Benzyloxy)phenyl)ethan-1-ol
4-(Benzyloxy)benzeneethanol
2-[4-(Benzyloxy)phenyl]ethan-1-ol
2-(4-Phenylmethoxyphenyl)ethanol

Work with 4-(Phenylmethoxy)benzeneethanol

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

(4-(Benzyloxy)phenyl)methanol836-43-170 % similar Hydroquinone dibenzyl ether621-91-069 % similar Benzyl phenyl ether946-80-563 % similar Phenethyl alcohol60-12-862 % similar Monobenzone103-16-261 % similar 4-Benzyloxybenzyl chloride836-42-059 % similar 4-Benzyloxyaniline6373-46-258 % similar 4-Benzyloxybenzonitrile52805-36-458 % similar

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

Same formula

2-[2-(3-Methoxyphenyl)ethyl]phenol167145-13-3 Wang resin201058-08-4 1,1′-(Dimethoxymethylene)bis[benzene]2235-01-0 Nabumetone42924-53-8 Bisphenol A80-05-7

Elsewhere

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