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635-85-8

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Basic Information
CAS No.: 635-85-8
Name: 2-(3,4-dimethoxyphenyl)ethanamine
Article Data: 5
Molecular Structure:
Molecular Structure of 635-85-8 (2-(3,4-dimethoxyphenyl)ethanamine)
Formula: C10H15 N O2 . Cl H
Molecular Weight: 217.696
Synonyms: Benzeneethanamine,3,4-dimethoxy-, hydrochloride (9CI); Phenethylamine, 3,4-dimethoxy-, hydrochloride(6CI,8CI); 2-(3,4-Dimethoxyphenyl)ethylamine hydrochloride;3,4-Dimethoxyphenethylamine hydrochloride; Homoveratrylamine hydrochloride; b-(3,4-Dimethoxyphenyl)ethylaminehydrochloride
Melting Point: 195-196℃ (ethanol )
Boiling Point: 324.1 °C at 760 mmHg
Flash Point: 132.8 °C
Safety: Poison by intraperitoneal and intravenous routes. When heated to decomposition it emits very toxic fumes of NOx and HCl.
PSA: 44.48000
LogP: 2.70730
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Chemistry

Empirical Formula of 3,4-Dimethoxyphenethylamine hydrochloride (CAS NO.635-85-8): C10H16ClNO2
Molecular Weight: 217.6925 g/mol
Flash Point: 132.8 °C
Enthalpy of Vaporization: 56.61 kJ/mol
Boiling Point: 324.1 °C at 760 mmHg
Vapour Pressure: 0.000251 mmHg at 25 °C
Structure of 3,4-Dimethoxyphenethylamine hydrochloride (CAS NO.635-85-8):
                                
IUPAC Name: 2-(3,4-Dimethoxyphenyl)ethanamine hydrochloride
Canonical SMILES: COC1=C(C=C(C=C1)CCN)OC.Cl
InChI: InChI=1S/C10H15NO2.ClH/c1-12-9-4-3-8(5-6-11)7-10(9)13-2;/h3-4,7H,5-6,11H2,1-2H3;1H
InChIKey: WIOOTMZLCZPTDW-UHFFFAOYSA-N

Toxicity Data With Reference

1.    

ipr-rat LD50:146 mg/kg

     TXAPA9    Toxicology and Applied Pharmacology. 25 (1973),299.
2.    

ipr-mus LD50:363 mg/kg

     TXAPA9    Toxicology and Applied Pharmacology. 25 (1973),299.
3.    

ivn-dog LD50:122 mg/kg

     TXAPA9    Toxicology and Applied Pharmacology. 25 (1973),299.
4.    

ivn-mky LD50:220 mg/kg

     TXAPA9    Toxicology and Applied Pharmacology. 25 (1973),299.
5.    

ipr-gpg LD50:375 mg/kg

     TXAPA9    Toxicology and Applied Pharmacology. 25 (1973),299.

Safety Profile

Poison by intraperitoneal and intravenous routes. When heated to decomposition 3,4-Dimethoxyphenethylamine hydrochloride (CAS NO.635-85-8) emits very toxic fumes of NOx and HCl.

Specification

 3,4-Dimethoxyphenethylamine hydrochloride , its cas register number is 635-85-8. It also can be called 3,4-Dimethoxy-beta-phenylethylamine hydrochloride ; Phenethylamine, 3,4-dimethoxy-, hydrochloride ; and Benzeneethanamine, 3,4-dimethoxy-, hydrochloride (9CI) .