2,4-Dimethoxybenzylamine hydrochloride

C9H14ClNO2CAS 20781-21-9203.67 g/mol

Open in Covalent MOL file
ONH2OHCl
EtherPrimary amine

Properties

Molecular formula
C9H14ClNO2
Molar mass
203.67 g/mol
Exact mass
203.0713 Da
Melting point
189–191 °C
logP
1.58Crippen estimate
Polar surface area
44.5 Ų
H-bond donors / acceptors
1 / 3
Rotatable bonds
3

Hazards

Warning
Irritant (GHS07)

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

Precautionary statements

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
20781-21-9
SMILES
COc1ccc(CN)c(OC)c1.Cl
InChIKey
KJOWSAVFSCSBMZ-UHFFFAOYSA-N
InChI
InChI=1S/C9H13NO2.ClH/c1-11-8-4-3-7(6-10)9(5-8)12-2;/h3-5H,6,10H2,1-2H3;1H

Weigh it out

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

Names and synonyms

4 names
  • Benzenemethanamine, 2,4-dimethoxy-, hydrochloride (1:1)
  • Benzylamine, 2,4-dimethoxy-, hydrochloride
  • Benzenemethanamine, 2,4-dimethoxy-, hydrochloride
  • (2,4-Dimethoxyphenyl)methanamine hydrochloride

Work with 2,4-Dimethoxybenzylamine 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

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.

2,4-Dimethoxybenzylamine20781-20-8Free base

Similar compounds

2,5-Dimethoxybenzenemethanamine3275-95-467 % similar 2,4,6-Trimethoxybenzylamine hydrochloride146548-59-662 % similar 2,5-Dimethoxyphenethylamine hydrochloride3166-74-358 % similar 2,4-Dimethoxybenzyl alcohol7314-44-557 % similar 1,2,4-Trimethoxybenzene135-77-355 % similar 2-Methoxybenzylamine6850-57-353 % similar 2,4-Dimethoxyaniline2735-04-850 % similar 2C-H3600-86-050 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

3-Methoxy-4-hydroxyphenylethylamine hydrochloride1477-68-5 D-Tyrosinol hydrochloride40829-04-7 Synephrine hydrochloride5985-28-4 (-)-Phenylephrine hydrochloride61-76-7 Methyldopamine hydrochloride62-32-8 1-(2-Aminoethoxy)-2-methoxybenzene hydrochloride64464-07-9 3-Hydroxy-4-methoxyphenethylamine hydrochloride645-33-0 4-((2S)-2-Amino-3-hydroxypropyl)phenol hydrochloride87745-27-5

Elsewhere

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