3-Chloro-4-methoxybenzylamine hydrochloride

C₈H₁₁Cl₂NOCAS 41965-95-1208.08 g/mol

Open in Covalent MOL file

Aryl halide Ether Primary amine

Properties

Molecular formula: C₈H₁₁Cl₂NO
Molar mass: 208.08 g/mol
Exact mass: 207.0218 Da
Melting point: 231–234 °C
logP: 2.23Crippen estimate
Polar surface area: 35.3 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 2

Identifiers

CAS number

41965-95-1

SMILES

COc1ccc(CN)cc1Cl.Cl

InChIKey

IKWWOZCEHOYKAO-UHFFFAOYSA-N

InChI

InChI=1S/C8H10ClNO.ClH/c1-11-8-3-2-6(5-10)4-7(8)9;/h2-4H,5,10H2,1H3;1H

Weigh it out

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

Names and synonyms

2 names

Benzenemethanamine, 3-chloro-4-methoxy-, hydrochloride (1:1)
Benzenemethanamine, 3-chloro-4-methoxy-, hydrochloride

Work with 3-Chloro-4-methoxybenzylamine hydrochloride

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

3-Chloro-4-methoxybenzenemethanamine115514-77-790 % similar Veratrylamine5763-61-167 % similar 3-Methoxy-4-hydroxybenzylamine hydrochloride7149-10-259 % similar 3,4-Dichlorobenzenemethanamine102-49-853 % similar 3-Chloro-4-methoxyaniline5345-54-051 % similar 3-Chloro-4-methylbenzylamine67952-93-651 % similar 2-Chloro-1,4-dimethoxybenzene2100-42-750 % similar 2-Chloro-4-fluoro-1-methoxybenzene2267-25-647 % similar

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

Same formula

2-Chloromethyl-4-methoxy-3-methylpyridine hydrochloride124473-12-7 Dichlormid37764-25-3

Elsewhere

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