3,4-Dimethoxy-N-methylphenethylamine hydrochloride

Base Information

• Chemical Name: 3,4-Dimethoxy-N-methylphenethylamine hydrochloride
• CAS No.: 13078-76-7
• Molecular Formula: C11H17NO2^.HCl
• Molecular Weight: 231.722
• Hs Code.: 2922299090
• European Community (EC) Number: 235-981-6
• NSC Number: 123409
• DSSTox Substance ID: DTXSID60156739
• Mol file: 13078-76-7.mol

Synonyms:N-Methyl-3,4-dimethoxybenzeneethanamine hydrochloride;N-Methyl-3,4-dimethoxyphenethylamine hydrochloride;Benzeneethanamine,3,4-dimethoxy-N-methyl-, hydrochloride (9CI);Phenethylamine, 3,4-dimethoxy-N-methyl-,hydrochloride (7CI,8CI);

Chemical Property of 3,4-Dimethoxy-N-methylphenethylamine hydrochloride

Chemical Property:

• Vapor Pressure: 0.00163mmHg at 25°C
• Melting Point: 140-142 °C(lit.)
• Boiling Point: 294.4 °C at 760 mmHg
• Flash Point: 115.1 °C
• PSA: 30.49000
• Density: 0.998g/cm3
• LogP: 2.65860
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 5
• Exact Mass: 231.1026065
• Heavy Atom Count: 15
• Complexity: 152

Purity/Quality:

98%,99%, ^*data from raw suppliers

3,4-Dimethoxy-N-methyl-benzeneethanamineHydrochloride ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-37/39

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: CNCCC1=CC(=C(C=C1)OC)OC.Cl
• Uses: 3,4-Dimethoxy-N-methylphenethylamine hydrochloride may be used in chemical synthesis.

Technology Process of 3,4-Dimethoxy-N-methylphenethylamine hydrochloride

There total 5 articles about 3,4-Dimethoxy-N-methylphenethylamine hydrochloride which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 98.2%

(+/-)-1-(3,4-dimethoxy-phenyl)-2-methylamino-ethanol; hydrochloride (54869-16-8) → <2-(3,4-dimethoxyphenyl)ethyl>methylamine hydrochloride (13078-76-7)

Guidance literature:

(+/-)-1-(3,4-dimethoxy-phenyl)-2-methylamino-ethanol; hydrochloride; aluminum (III) chloride; In water; at 85 ℃;

With hydrogen; 5%-palladium/activated carbon; In water; at 85 ℃; for 36h; under 2585.81 Torr;

With hydrogenchloride; sodium hydroxide; more than 3 stages; Product distribution / selectivity;

Reference yield: 97.9%

1-(3,4-dimethoxy-phenyl)-2-methylamino-ethanone; hydrochloride (40511-15-7) → <2-(3,4-dimethoxyphenyl)ethyl>methylamine hydrochloride (13078-76-7)

Guidance literature:

1-(3,4-dimethoxy-phenyl)-2-methylamino-ethanone; hydrochloride; With hydrogen; 5%-palladium/activated carbon; In water; at 75 ℃; for 16 - 40h;

With hydrogen; aluminum (III) chloride; In water; for 20 - 105h; under 2585.81 Torr;

With hydrogenchloride; sodium hydroxide; more than 3 stages; Product distribution / selectivity;

Reference yield:

1-(3,4-dimethoxy-phenyl)-2-methylamino-ethanone; hydrochloride (40511-15-7) → (+/-)-1-(3,4-dimethoxy-phenyl)-2-methylamino-ethanol; hydrochloride (54869-16-8) + <2-(3,4-dimethoxyphenyl)ethyl>methylamine hydrochloride (13078-76-7)

Guidance literature:

1-(3,4-dimethoxy-phenyl)-2-methylamino-ethanone; hydrochloride; With hydrogen; 5%-palladium/activated carbon; In water; at 75 ℃; for 24h;

With hydrogenchloride; hydrogen; In water; for 19 - 96h; Product distribution / selectivity;

upstream raw materials:

(+/-)-1-(3,4-dimethoxy-phenyl)-2-methylamino-ethanol; hydrochloride

1-(3,4-dimethoxy-phenyl)-2-methylamino-ethanone; hydrochloride

1-(4-methoxyphenyl)-2-(methylamino)ethan-1-one hydrochloride

Downstream raw materials:

verapamil hydrochloride

2-isopropyl-1-[4-{3-[N-methyl-N-(3,4-dimethoxy-β-phenethyl)amino]-propyloxy}benzenesulphonyl]indolizine hydrochloride

(+/-)-carnegine

(S)-verapamil

Refernces