4-Benzyloxyanisole

C₁₄H₁₄O₂CAS 6630-18-8214.26 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₄H₁₄O₂
Molar mass: 214.26 g/mol
Exact mass: 214.0994 Da
logP: 3.27Crippen estimate
Polar surface area: 18.5 Å²
H-bond donors / acceptors: 0 / 2
Rotatable bonds: 4

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number

6630-18-8

SMILES

COC1=CC=C(C=C1)OCC2=CC=CC=C2

InChIKey

YXPFQYIWXTVCKV-UHFFFAOYSA-N

InChI

InChI=1S/C14H14O2/c1-15-13-7-9-14(10-8-13)16-11-12-5-3-2-4-6-12/h2-10H,11H2,1H3

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Work with 4-Benzyloxyanisole

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

Hydroquinone dibenzyl ether621-91-075 % similar 4-Benzyloxyaniline6373-46-262 % similar Monobenzone103-16-260 % similar 4-Benzyloxyiodobenzene19578-68-860 % similar 1-Fluoro-4-(phenylmethoxy)benzene370-78-560 % similar 1-(Benzyloxy)-4-bromobenzene6793-92-660 % similar 4-Benzyloxychlorobenzene7700-27-860 % similar 4-Benzyloxybenzyl chloride836-42-058 % similar

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

Same formula

1,2-Diphenoxyethane104-66-5 4,4'-Bis(hydroxymethyl)biphenyl1667-12-5 3-(Phenylmethoxy)benzenemethanol1700-30-7 Ethyl 1-naphthylacetate2122-70-5 4,4'-Dimethoxybiphenyl2132-80-1 (S,S)-(-)-Hydrobenzoin2325-10-2 α-Naphthyl butyrate3121-70-8 2,2'-Dimethoxybiphenyl4877-93-4

Elsewhere

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