2-(Aminomethyl)benzimidazole dihydrochloride hydrate

Base Information

• Chemical Name: 2-(Aminomethyl)benzimidazole dihydrochloride hydrate
• CAS No.: 5993-91-9
• Molecular Formula: C8H9N3^.2(HCl)
• Molecular Weight: 220.101
• Hs Code.: 2933990090
• European Community (EC) Number: 227-820-3
• Mol file: 5993-91-9.mol

Synonyms:2-(Aminomethyl)benzimidazole dihydrochloride hydrate;1155659-33-8;(1H-Benzo[d]imidazol-2-yl)methanamine dihydrochloride hydrate;MFCD00150073;1H-Benzimidazole-2-methanamine, hydrochloride, hydrate (1:2:1);Benzimidazol-2-ylmethylamine dihydrochloride hydrate;1H-Benzimidazole-2-methanamine dihydroChloride;EINECS 227-820-3;Benzimidazol-2-ylmethylamine HCl hydrate;QHEZHWNFSVYUGT-UHFFFAOYSA-N;AC1020;NSC 102325;CS-11796;SY030589;DIHYDRO-2-(AMINOMETHYL)BENZIMIDAZOLE;CS-0441285;2-(Aminomethyl)benzimidazoledihydrochloridehydrate;2-aminomethylbenzimidazole dihydrochloride hydrate;2-aminomethyl benzimidazole dihydrochloride hydrate;2-aminomethyl-benzimidazole dihydrochloride hydrate;Q-101104;2-(aminomethyl)-benzimidazole dihydrochloride hydrate;(1H-benzimidazol-2-ylmethyl)amine dihydrochloride hydrate;2-(ammoniomethyl)-1H-benzimidazol-1-ium dichloride hydrate

Chemical Property of 2-(Aminomethyl)benzimidazole dihydrochloride hydrate

Chemical Property:

• Vapor Pressure: 4.12E-06mmHg at 25°C
• Melting Point: 264 °C (dec.)(lit.)
• Boiling Point: 214.5 °C
• Flash Point: 384.3 °C at 760 mmHg
• PSA: 63.93000
• LogP: 3.26160
• Storage Temp.: Inert atmosphere,Room Temperature
• Hydrogen Bond Donor Count: 5
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 237.0435674
• Heavy Atom Count: 14
• Complexity: 137

Purity/Quality:

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

(1H-Benzo[d]imidazol-2-yl)methanamineDihydrochloride ^*data from reagent suppliers

Safty Information:

• Safety Statements: 22-24/25

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C2C(=C1)NC(=N2)CN.O.Cl.Cl
• Uses: 2-(Aminomethyl)benzimidazole dihydrochloride was used in the synthesis of N-(benzimidazol-2-ylmethyl)iminodiacetic acid.

Technology Process of 2-(Aminomethyl)benzimidazole dihydrochloride hydrate

There total 5 articles about 2-(Aminomethyl)benzimidazole dihydrochloride hydrate 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: 89.0%

1,2-diamino-benzene (95-54-5) + glycine (56-40-6,18875-39-3,25718-94-9) → 2-(aminomethyl)benzimidazole dihydrochloride (5993-91-9)

Guidance literature:

With hydrogenchloride; In water; for 30h; Reflux;

DOI:10.1016/j.bmcl.2009.03.069

Reference yield: 47.0%

N-[(1H-benzo[d]imidazol-2-yl)methyl]acetamide (30770-21-9) → 2-(aminomethyl)benzimidazole dihydrochloride (5993-91-9)

Guidance literature:

With hydrogenchloride; In methanol; for 2h; Heating;

DOI:10.1007/s00044-005-0125-z

Reference yield:

1,2-diamino-benzene (95-54-5) → 2-(aminomethyl)benzimidazole dihydrochloride (5993-91-9)

Guidance literature:

Multi-step reaction with 2 steps

1: 36 percent / xylene / 14 h / Heating

2: 47 percent / aq. HCl / methanol / 2 h / Heating

With hydrogenchloride; In methanol; xylene;

DOI:10.1007/s00044-005-0125-z

upstream raw materials:

1,2-diamino-benzene

glycine

N-[(1H-benzo[d]imidazol-2-yl)methyl]acetamide

Downstream raw materials:

1-(1H-Benzoimidazol-2-ylmethyl)-3-(4-bromo-phenyl)-thiourea

Methyl (+/-)-7-[[[(2-benzimidazolyl)methyl]amino]carbonyl]-3-oxo-4-(2-phenylethyl)-2,3,4,5-tetrahydro-1H-1,4-benzodiazepine-2-acetate

2-chloro-4-(2-chloro-4-methoxyphenoxy)-6-[(1H-benzoimidazol-2-ylmethyl)-amino]pyrimidine

6-chloro-4-(2-chloro-4-methoxyphenoxy)-2-[(1H-benzoimidazol-2-ylmethyl)-amino]pyrimidine

Refernces

• 1、 -. "PREVENTION AND TREATMENT OF HUMAN METABOLIC SYNDROME INCLUDING TYPE 2 DIABETES, STEATOHEPITITIS AND RELATED CONDITIONS USING NON-ABSORBABLE, ORALLY ADMINISTERED COMPOUNDS". Page/Page column 16. . Retrieved 2019/07/19.
• 2、 El-Seidy, Ahmed M. A.,El-Zahany, Eman,Barakat, Atiat S.,Youssef, Nabil S.,Galal, Shadia A.,Drweesh, Sayed A.. "Synthesis, characterization, and cytotoxic activity on MCF-7 cell line of some novel metal complexes with substituted benzimidazole ligands". . p. 46 - 56. Retrieved 2013/02/25.