3,4-Dimethyl-benzamidine hydrochloride

Base Information

• Chemical Name: 3,4-Dimethyl-benzamidine hydrochloride
• CAS No.: 112072-09-0
• Molecular Formula: C₉H₁₂N₂*ClH
• Molecular Weight: 184.669
• Hs Code.: 2925290090
• DSSTox Substance ID: DTXSID30695983
• Mol file: 112072-09-0.mol

Synonyms:112072-09-0;3,4-DIMETHYL-BENZAMIDINE HYDROCHLORIDE;3,4-Dimethylbenzimidamide hydrochloride;3,4-dimethylbenzenecarboximidamide;hydrochloride;3,4-dimethylbenzene-1-carboximidamide hydrochloride;3,4-Dimethylbenzamidine HCl;SCHEMBL5118627;DTXSID30695983;MFCD08059236;3,4-Dimethylbenzamidine hydrochloride;3,4-Dimethylbenzimidamidehydrochloride;AKOS016012979;AS-6383;SB30703;3,4-Dimethyl-benzamidine;FT-0691989;3,4-dimethylbenzenecarboximidamide hydrochloride;A802482;F9995-2767;3,4-Dimethylbenzene-1-carboximidamide--hydrogen chloride (1/1)

Chemical Property of 3,4-Dimethyl-benzamidine hydrochloride

Chemical Property:

• Melting Point: 195-196 °C(Solv: methanol (67-56-1); ethyl acetate (141-78-6))
• PSA: 49.87000
• LogP: 3.18950
• Storage Temp.: Sealed in dry,Room Temperature
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 184.0767261
• Heavy Atom Count: 12
• Complexity: 154

Purity/Quality:

98% ^*data from raw suppliers

3,4-Dimethyl-benzamidineHydrochloride ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(C=C(C=C1)C(=N)N)C.Cl
• Uses: 3,4-Dimethyl-benzamidine Hydrochloride can be used as inhibitor of thrombin. It can also be prepared as an cardiovascular agents.

Technology Process of 3,4-Dimethyl-benzamidine hydrochloride

There total 1 articles about 3,4-Dimethyl-benzamidine 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:

→ 3,4-dimethyl-benzamidine; hydrochloride (112072-09-0)

Guidance literature:

Reference yield:

3,4-dimethyl-benzamidine; hydrochloride (112072-09-0) → N-methoxy-3,4-dimethyl-benzamidine (111961-64-9)

Guidance literature:

Multi-step reaction with 2 steps

1: aqueous NaOH; NH₂OH+HCl / bei pH 7-8

2: aqueous NaOH; aqueous methanol. H₃BO₃ / bei pH 5,6-5,8

With hydrogenchloride; sodium hydroxide; hydroxylamine; boric acid;

Reference yield:

3,4-dimethyl-benzamidine; hydrochloride (112072-09-0) → 3,4-dimethyl-benzamide oxime (40312-15-0)

Guidance literature:

With hydrogenchloride; sodium hydroxide; hydroxylamine; bei pH 7-8;

Downstream raw materials:

3,4-dimethyl-benzamide oxime

N-methoxy-3,4,N-trimethyl-benzamidine

N-methoxy-3,4-dimethyl-benzamidine

N-ethoxy-3,4-dimethyl-benzamidine

Refernces