2-(Chloromethyl)-3,4-dimethoxypyridine

C8H10ClNO2CAS 169905-10-6187.62 g/mol

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ONClO
Alkyl halideEther

Properties

Molecular formula
C8H10ClNO2
Molar mass
187.62 g/mol
Exact mass
187.0400 Da
logP
1.84Crippen estimate
Polar surface area
31.4 Ų
H-bond donors / acceptors
0 / 3
Rotatable bonds
3

Hazards

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

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Identifiers

CAS number
169905-10-6
SMILES
COc1ccnc(CCl)c1OC
InChIKey
ZWFCXDBCXGDDOM-UHFFFAOYSA-N
InChI
InChI=1S/C8H10ClNO2/c1-11-7-3-4-10-6(5-9)8(7)12-2/h3-4H,5H2,1-2H3

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Names and synonyms

2 names
  • Pyridine, 2-(chloromethyl)-3,4-dimethoxy-
  • 2-Chloromethyl-3,4-dimethoxypyridine

Work with 2-(Chloromethyl)-3,4-dimethoxypyridine

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

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

2-Chloromethyl-3,4-dimethoxypyridinium chloride72830-09-2Salt

Similar compounds

3,4-Dimethoxy-2-pyridinemethanol72830-08-165 % similar 2-Chloromethyl-4-methoxy-3-methylpyridine hydrochloride124473-12-762 % similar 1-(Chloromethyl)-2,3-dimethoxybenzene3893-01-450 % similar 3,4,5-Trimethoxybenzyl chloride3840-30-046 % similar 2-(Chloromethyl)-4-(3-methoxypropoxy)-3-methylpyridine117977-20-545 % similar 2-(Chloromethyl)-4-methoxy-3,5-dimethylpyridine84006-10-045 % similar 2-(Chloromethyl)-3-methyl-4-(2,2,2-trifluoroethoxy)pyridine128430-66-043 % similar 4,7-Dimethoxy-1,10-phenanthroline92149-07-043 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

4-Chloro-2,5-dimethoxyaniline6358-64-1 3-(Aminomethyl)benzoic acid hydrochloride876-03-9 3'-Amino-2'-hydroxyacetophenone hydrochloride90005-55-3 5-Chloro-2,4-dimethoxyaniline97-50-7

Elsewhere

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