chempirical

3-Hydroxy-4-methoxyphenethylamine hydrochloride

C9H14ClNO2CAS 645-33-0203.67 g/mol

Open in Covalent MOL file
ONH2HOHCl
EtherPhenolPrimary amine

Properties

Molecular formula
C9H14ClNO2
Molar mass
203.67 g/mol
Exact mass
203.0713 Da
Melting point
206–207 °C
logP
1.32Crippen estimate
Polar surface area
55.5 Ų
H-bond donors / acceptors
2 / 3
Rotatable bonds
3

Hazards

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

Identifiers

CAS number
645-33-0
SMILES
COc1ccc(CCN)cc1O.Cl
InChIKey
KAAFITWSSODFMA-UHFFFAOYSA-N
InChI
InChI=1S/C9H13NO2.ClH/c1-12-9-3-2-7(4-5-10)6-8(9)11;/h2-3,6,11H,4-5,10H2,1H3;1H

Weigh it out

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Names and synonyms

7 names
  • Phenol, 5-(2-aminoethyl)-2-methoxy-, hydrochloride (1:1)
  • Phenol, 5-(2-aminoethyl)-2-methoxy-, hydrochloride
  • Guaiacol, 5-(2-aminoethyl)-, hydrochloride
  • 4-O-Methyldopamine hydrochloride
  • 3-Hydroxy-4-methoxy-β-phenethylamine hydrochloride
  • 2-(3-Hydroxy-4-methoxyphenyl)ethanamine hydrochloride
  • 5-(2-Aminoethyl)-2-methoxyphenol hydrochloride

Work with 3-Hydroxy-4-methoxyphenethylamine 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-Methoxytyramine554-52-970 % similar 3,4-Dimethoxyphenethylamine120-20-769 % similar Dopamine hydrochloride62-31-764 % similar Erianin95041-90-062 % similar Isovanillyl alcohol4383-06-658 % similar 3-Methoxy-4-hydroxybenzylamine hydrochloride7149-10-256 % similar Dopamine51-61-656 % similar 3,4-Methylenedioxy-β-phenylethylamine hydrochloride1653-64-153 % similar

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

Same formula

3-Methoxy-4-hydroxyphenylethylamine hydrochloride1477-68-5 2,4-Dimethoxybenzylamine hydrochloride20781-21-9 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 4-((2S)-2-Amino-3-hydroxypropyl)phenol hydrochloride87745-27-5

Elsewhere

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