1-Isoquinolin-1-ylmethanamine dihydrochloride

Base Information

• Chemical Name: 1-Isoquinolin-1-ylmethanamine dihydrochloride
• CAS No.: 19382-38-8
• Molecular Formula: C10H10 N2 . 2 Cl H
• Molecular Weight: 231.12
• Hs Code.: 2933499090
• European Community (EC) Number: 862-535-3
• DSSTox Substance ID: DTXSID80482062
• Mol file: 19382-38-8.mol

Synonyms:19382-38-8;1-isoquinolin-1-ylmethanamine dihydrochloride;Isoquinolin-1-ylmethanamine dihydrochloride;C-isoquinolin-1-yl-methylamine dihydrochloride;isoquinolin-1-ylmethanamine;dihydrochloride;isoquinolin-1-ylmethanamine 2HCl;MFCD06796244;(isoquinolin-1-yl)methanamine dihydrochloride;1-(1-Isoquinolinyl)Methanamine Dihydrochloride;SCHEMBL5214220;DTXSID80482062;Isoquinolin-1-ylmethanamine diHCl;NSZXYJPWXMGVFU-UHFFFAOYSA-N;AKOS022176077;DS-7652;Isoquinolin-1-ylmethanaminedihydrochloride;SY335446;Iisoquinolin-1-ylmethanamine Dihydrochloride;CS-0060585;EN300-26037;W17268;1-(ISOQUINOLIN-1-YL)METHANAMINE DIHYDROCHLORIDE;Z220439492

Chemical Property of 1-Isoquinolin-1-ylmethanamine dihydrochloride

Chemical Property:

• Melting Point: 187-188 °C (decomp)
• PSA: 38.91000
• LogP: 3.99780
• Storage Temp.: Inert atmosphere,Room Temperature
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 230.0377538
• Heavy Atom Count: 14
• Complexity: 147

Purity/Quality:

98% ^*data from raw suppliers

Isoquinolin-1-yl-methylaminedihydrochloride 96% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C2C(=C1)C=CN=C2CN.Cl.Cl

Technology Process of 1-Isoquinolin-1-ylmethanamine dihydrochloride

There total 1 articles about 1-Isoquinolin-1-ylmethanamine dihydrochloride 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: 73.0%

4-(1-Isoquinolyl)-2-phenyl-2-oxazolin-5-one (113883-31-1,142052-74-2) → 1-(Aminomethyl)isoquinoline dihydrochloride (19382-38-8,1177303-46-6)

Guidance literature:

With hydrogenchloride; for 6h; Heating;

Reference yield: 32.0%

chloroform (67-66-3,8013-54-5) + 1-(Aminomethyl)isoquinoline dihydrochloride (19382-38-8,1177303-46-6) → 2-formamidomethylisoquinoline (58021-71-9) + Imidazo<5,1-a>isochinolin (234-61-7)

Guidance literature:

With sodium hydroxide; tetra-n-propylammonium bromide; In 1,2-dimethoxyethane; at 50 ℃; for 3.25h;

DOI:10.1021/jo00007a028

Reference yield:

[1-(3,4-Dimethoxy-benzyl)-7,8-dimethoxy-1,3,4,5-tetrahydro-benzo[c]azepin-2-yl]-phenyl-acetic acid (439933-59-2) + 1-(Aminomethyl)isoquinoline dihydrochloride (19382-38-8,1177303-46-6) → 2-[1-(3,4-Dimethoxy-benzyl)-7,8-dimethoxy-1,3,4,5-tetrahydro-benzo[c]azepin-2-yl]-N-isoquinolin-1-ylmethyl-2-phenyl-acetamide (440098-95-3)

Guidance literature:

upstream raw materials:

4-(1-Isoquinolyl)-2-phenyl-2-oxazolin-5-one

Downstream raw materials:

2-formamidomethylisoquinoline

Imidazo<5,1-a>isochinolin

2-[1-(3,4-Dimethoxy-benzyl)-7,8-dimethoxy-1,3,4,5-tetrahydro-benzo[c]azepin-2-yl]-N-isoquinolin-1-ylmethyl-2-phenyl-acetamide

Refernces