4-(2-Chloroethyl)phenyl methyl ether

C₉H₁₁ClOCAS 18217-00-0170.64 g/mol

Open in Covalent MOL file

Alkyl halide Ether

Properties

Molecular formula: C₉H₁₁ClO
Molar mass: 170.64 g/mol
Exact mass: 170.0498 Da
Boiling point: 136–139 °C (at 24 Torr)
logP: 2.48Crippen estimate
Polar surface area: 9.2 Å²
H-bond donors / acceptors: 0 / 1
Rotatable bonds: 3

Hazards

Warning

H341 Suspected of causing genetic defects100% of notifiers

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

Precautionary statements

P203, P280, P318, P405, P501

Identifiers

CAS number

18217-00-0

SMILES

COc1ccc(CCCl)cc1

InChIKey

PMIAMRAWHYEPNH-UHFFFAOYSA-N

InChI

InChI=1S/C9H11ClO/c1-11-9-4-2-8(3-5-9)6-7-10/h2-5H,6-7H2,1H3

Weigh it out

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

Names and synonyms

9 names

1-(2-Chloroethyl)-4-methoxybenzene
Benzene, 1-(2-chloroethyl)-4-methoxy-
Anisole, p-(2-chloroethyl)-
4-Methoxyphenethyl chloride
p-Methoxyphenethyl chloride
p-(2-Chloroethyl)anisole
1-Chloro-2-(4-methoxyphenyl)ethane
4-(2-Chloroethyl)anisole
2-(4-Methoxyphenyl)ethylchloride

Work with 4-(2-Chloroethyl)phenyl methyl ether

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-Methoxybenzyl chloride824-94-265 % similar 4-Propylanisole104-45-059 % similar 2-(4-Methoxyphenyl)ethylamine55-81-257 % similar 2-(4-Methoxyphenyl)ethanol702-23-857 % similar 1-Ethyl-4-methoxybenzene1515-95-356 % similar 1,4-Dimethoxybenzene150-78-755 % similar Anisyl alcohol105-13-554 % similar Bis(4-methoxybenzyl)amine17061-62-054 % similar

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

Same formula

(1R)-3-Chloro-1-phenyl-propan-1-ol100306-33-0 (-)-3-Chloro-1-phenyl-1-propanol100306-34-1 Benzyl 2-chloroethyl ether17229-17-3 3-Chloro-1-phenyl-1-propanol18776-12-0 4-Chlorobenzenepropanol6282-88-8

Elsewhere

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