m-Aminobenzamidine dihydrochloride

Base Information

• Chemical Name: m-Aminobenzamidine dihydrochloride
• CAS No.: 37132-68-6
• Molecular Formula: C₇H₉N₃*2ClH
• Molecular Weight: 208.09
• Hs Code.: 29242998
• European Community (EC) Number: 253-355-0
• DSSTox Substance ID: DTXSID20958337
• Mol file: 37132-68-6.mol

Synonyms:37132-68-6;3-Aminobenzamidine dihydrochloride;m-Aminobenzamidine dihydrochloride;3-Aminobenzamidine DiHCl;m-Aminobenzamidine HCl;3-aminobenzenecarboximidamide;dihydrochloride;EINECS 253-355-0;C7-H9-N3.2Cl-H;3-AminobenzamidineDiHCl;3-aminobenzamidine di-hcl;3-Aminobenzamidine2HClhydrate;SCHEMBL616601;DTXSID20958337;3-Aminobenzamidine,dihydrochloride;FKFMMMVFFYPIEE-UHFFFAOYSA-N;AKOS015888348;AB01115;3-Aminobenzamidine dihydrochloride, 96%;3-AMINOBENZIMIDAMIDE DIHYDROCHLORIDE;CS-0206374;H11407;3-aminobenzene-1-carboximidamide dihydrochloride;A874178;3-Aminobenzene-1-carboximidamide--hydrogen chloride (1/2)

Chemical Property of m-Aminobenzamidine dihydrochloride

Chemical Property:

• Vapor Pressure: 0.00073mmHg at 25°C
• Melting Point: 262-264 °C(lit.)
• Boiling Point: 307.3°Cat760mmHg
• Flash Point: 139.7°C
• PSA: 85.12000
• Density: g/cm³
• LogP: 3.47380
• Storage Temp.: 2-8°C
• Hydrogen Bond Donor Count: 5
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 207.0330028
• Heavy Atom Count: 12
• Complexity: 133

Purity/Quality:

98% ^*data from raw suppliers

3-Aminobenzamidine dihydrochloride ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xn,Xi
• Statements: 36/37/38-22-43
• Safety Statements: 36/37/39-26-36-36/37

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: C1=CC(=CC(=C1)N)C(=N)N.Cl.Cl
• Uses: 3-Aminobenzamidine Dihydrochloride is a reactant that has been used in the synthesis of N-phenylamidines as selective inhibitors of human neuronal nitric oxide synthase.

Technology Process of m-Aminobenzamidine dihydrochloride

There total 1 articles about m-Aminobenzamidine 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:

3-nitrobenzamidine hydrochloride (56406-50-9) → 3-aminobenzamidine dihydrochloride (3459-67-4,15723-86-1,37132-68-6)

Guidance literature:

With hydrogen; platinum(IV) oxide;

Reference yield: 100.0%

3-amino-6-bromopyrazine-2-carbohydrazide (1225062-23-6) + 3-aminobenzamidine dihydrochloride (3459-67-4,15723-86-1,37132-68-6) → 3-(5-(3-aminophenyl)-4H-1,2,4-triazol-3-yl)-5-bromopyrazin-2-amine (1225062-24-7)

Guidance literature:

With sodium ethanolate; In N,N-dimethyl-formamide; at 100 ℃; for 0.333333h; Microwave irradiation;

Reference yield: 82.0%

S-benzyl thioacetimidate hydrochloride (32894-07-8) + 3-aminobenzamidine dihydrochloride (3459-67-4,15723-86-1,37132-68-6) → 3-Acetimidoylamino-benzamidine; hydrochloride

Guidance literature:

With triethylamine; In ethanol; Ambient temperature;

DOI:10.1021/jm980072p

upstream raw materials:

3-nitrobenzamidine hydrochloride

Downstream raw materials:

3-[3-(4-benzylsulfamoyl-phenyl)-thioureido]-benzamidine

3-(5-(3-aminophenyl)-4H-1,2,4-triazol-3-yl)-5-bromopyrazin-2-amine

3-aminobenzamidine monohydrochloride

Refernces