chempirical

2-Methoxybenzyl chloride

C8H9ClOCAS 7035-02-1156.61 g/mol

Open in Covalent MOL file
OCl
Alkyl halideEther

Properties

Molecular formula
C8H9ClO
Molar mass
156.61 g/mol
Exact mass
156.0342 Da
Melting point
29–30 °C
Boiling point
111–112 °C (at 11 Torr)
logP
2.43Crippen estimate
Polar surface area
9.2 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
2

Identifiers

CAS number
7035-02-1
SMILES
COc1ccccc1CCl
InChIKey
UAWVMPOAIVZWFQ-UHFFFAOYSA-N
InChI
InChI=1S/C8H9ClO/c1-10-8-5-3-2-4-7(8)6-9/h2-5H,6H2,1H3

Weigh it out

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

Names and synonyms

5 names
  • Benzene, 1-(chloromethyl)-2-methoxy-
  • Anisole, o-(chloromethyl)-
  • 1-(Chloromethyl)-2-methoxybenzene
  • o-Methoxybenzyl chloride
  • 2-(Chloromethyl)anisole

Work with 2-Methoxybenzyl 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

2-Methoxybenzyl alcohol612-16-859 % similar 2-Methoxybenzylamine6850-57-359 % similar 2-Methoxyphenethylamine2045-79-655 % similar 2-Methoxybenzeneacetonitrile7035-03-255 % similar 2-(2-Methoxyphenyl)ethanol7417-18-755 % similar α,Α′-Dichloro-O-xylene612-12-454 % similar 1,2-Dimethoxybenzene91-16-754 % similar Methyl 2-methoxybenzeneacetate27798-60-349 % similar

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

Same formula

4-Chloro-2,6-dimethylphenol1123-63-3 (1R)-1-(3-Chlorophenyl)ethanol120121-01-9 (1R)-1-(2-Chlorophenyl)ethan-1-ol120466-66-2 (S)-1-(2-Chlorophenyl)ethanol131864-71-6 1-Chloro-4-methoxy-2-methylbenzene13334-71-9 (1S)-1-(3-Chlorophenyl)ethan-1-ol135145-34-5 1-(2-Chlorophenyl)ethanol13524-04-4 4-Chloro-3-ethylphenol14143-32-9

Elsewhere

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