4-(Benzyloxy)benzoyl chloride

C₁₄H₁₁ClO₂CAS 1486-50-6246.69 g/mol

Open in Covalent MOL file

Acyl halide Ether

Properties

Molecular formula: C₁₄H₁₁ClO₂
Molar mass: 246.69 g/mol
Exact mass: 246.0448 Da
logP: 3.64Crippen estimate
Polar surface area: 26.3 Å²
H-bond donors / acceptors: 0 / 2
Rotatable bonds: 4

Identifiers

CAS number

1486-50-6

SMILES

C1=CC=C(C=C1)COC2=CC=C(C=C2)C(=O)Cl

InChIKey

ICEKEZSKMGHZNT-UHFFFAOYSA-N

InChI

InChI=1S/C14H11ClO2/c15-14(16)12-6-8-13(9-7-12)17-10-11-4-2-1-3-5-11/h1-9H,10H2

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Names and synonyms

1 names

4-Benzyloxybenzoylchloride

Work with 4-(Benzyloxy)benzoyl chloride

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)benzoic acid1486-51-762 % similar 4-Benzyloxyacetophenone54696-05-862 % similar 1-[4-(Phenylmethoxy)phenyl]-1-propanone4495-66-361 % similar Hydroquinone dibenzyl ether621-91-060 % similar 4-Ethoxybenzoyl chloride16331-46-758 % similar 4-Benzyloxybenzhydrazide128958-65-657 % similar Ethyl 4-(phenylmethoxy)benzoate56441-55-556 % similar Benzoyl chloride98-88-455 % similar

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

Elsewhere

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