1-(Chloromethyl)-6,7-dimethoxy-3,4-dihydroisoquinoline hydrochloride

Base Information

• Chemical Name: 1-(Chloromethyl)-6,7-dimethoxy-3,4-dihydroisoquinoline hydrochloride
• CAS No.: 52210-49-8
• Molecular Formula: C12H14ClNO2
• Molecular Weight: 239.6981
• DSSTox Substance ID: DTXSID80508812
• NSC Number: 64283
• Mol file: 52210-49-8.mol

Synonyms:52210-49-8;1-(chloromethyl)-6,7-dimethoxy-3,4-dihydroisoquinoline hydrochloride;1-(chloromethyl)-6,7-dimethoxy-3,4-dihydroisoquinoline;hydrochloride;SCHEMBL3452579;DTXSID80508812;NSC64283;NSC-64283;AKOS026746190;CS-0302359;EN300-237464;F2147-0395;1-(chloromethyl)-6,7-dimethoxy-3,4-dihydroisoquinolinehydrochloride;1-(Chloromethyl)-6,7-dimethoxy-3,4-dihydroisoquinoline--hydrogen chloride (1/1)

Chemical Property of 1-(Chloromethyl)-6,7-dimethoxy-3,4-dihydroisoquinoline hydrochloride

Chemical Property:

• Vapor Pressure: 0.000134mmHg at 25°C
• Boiling Point: 344.1°C at 760 mmHg
• Flash Point: 161.9°C
• Density: 1.23g/cm³
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 275.0479841
• Heavy Atom Count: 17
• Complexity: 270

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: COC1=C(C=C2C(=C1)CCN=C2CCl)OC.Cl

Technology Process of 1-(Chloromethyl)-6,7-dimethoxy-3,4-dihydroisoquinoline hydrochloride

There total 3 articles about 1-(Chloromethyl)-6,7-dimethoxy-3,4-dihydroisoquinoline 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: 86.0%

1-Chloromethyl-6,7-dimethoxy-3,4-dihydro-isoquinoline; compound with GENERIC INORGANIC NEUTRAL COMPONENT → 1-chloromethyl-6,7-dimethoxy-3,4-dihydroisoquinoline hydrogen chloride (52210-49-8)

Guidance literature:

With hydrogenchloride; In methanol; diethyl ether;

DOI:10.3987/COM-95-7285

Reference yield: 57.0%

→ 1-chloromethyl-6,7-dimethoxy-3,4-dihydroisoquinoline hydrogen chloride (52210-49-8)

Guidance literature:

Reference yield:

2-chloro-N-(2-(3,4-dimethoxyphenyl)ethyl)acetamide (14301-31-6) → 1-chloromethyl-6,7-dimethoxy-3,4-dihydroisoquinoline hydrogen chloride (52210-49-8)

Guidance literature:

2-chloro-N-(2-(3,4-dimethoxyphenyl)ethyl)acetamide; With phosphorus pentoxide; In 5,5-dimethyl-1,3-cyclohexadiene; Reflux; Inert atmosphere;

With hydrogenchloride; In diethyl ether; Inert atmosphere;

DOI:10.1039/c5ob00350d

upstream raw materials:

2-chloro-N-(2-(3,4-dimethoxyphenyl)ethyl)acetamide

Downstream raw materials:

(3,4-dihydro-6,7-dimethoxyisoquinolin-1-yl)acetonitrile

(+/-)-N-methylcalycotomine

(6,7-dimethoxy-1,2,3,4-tetrahydro-1-isoquinolyl)methanol