Methyl 3-bromobenzimidate hydrochloride

Base Information

• Chemical Name: Methyl 3-bromobenzimidate hydrochloride
• CAS No.: 56108-13-5
• Molecular Formula: C₈H₈BrNO*ClH
• Molecular Weight: 250.523
• Hs Code.: 2924297099

Synonyms:METHYL 3-BROMOBENZIMIDATE HYDROCHLORIDE;56108-13-5;Methyl3-BromobenzimidateHydrochloride;Methyl 3-bromobenzenecarboximidoate hydrochloride;methyl 3-bromobenzenecarboximidate;hydrochloride;Methyl 3-Bromobenzimidate HCl;SCHEMBL1784330;MBLOGWJDLCGTJI-UHFFFAOYSA-N;AC6360;MFCD10697946;AKOS027256972;SY028780;CS-0453624;A924091

Chemical Property of Methyl 3-bromobenzimidate hydrochloride

Chemical Property:

• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 248.95560
• Heavy Atom Count: 12
• Complexity: 149

Purity/Quality:

97% ^*data from raw suppliers

Methyl 3-bromobenzimidate hydrochloride ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC(=N)C1=CC(=CC=C1)Br.Cl

Technology Process of Methyl 3-bromobenzimidate hydrochloride

There total 2 articles about Methyl 3-bromobenzimidate 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: 93.0%

methanol (67-56-1) + 3-cyanobromobenzene (6952-59-6) → methyl 3-bromobenzenecarboximidoate hydrochloride (56108-13-5)

Guidance literature:

With hydrogenchloride; In diethyl ether; at 0 - 5 ℃;

DOI:10.1021/jm00008a007

Reference yield:

3-cyanobromobenzene (6952-59-6) → methyl 3-bromobenzenecarboximidoate hydrochloride (56108-13-5)

Guidance literature:

In methanol; toluene;

Reference yield: 91.0%

1,3,5-Triazine (290-87-9) + methyl 3-bromobenzenecarboximidoate hydrochloride (56108-13-5) → 2-(3-bromophenyl)-1,3,5-triazine

Guidance literature:

With acetic acid; In ethanol; for 20h; Reflux;

upstream raw materials:

methanol

3-cyanobromobenzene

Downstream raw materials:

3-bromobenzene-1-carboximidamide hydrochloride

2-[2-(3-Bromo-phenyl)-1H-imidazol-4-yl]-ethanol

N-[2,2-bis(ethyloxy)ethyl]-3-bromobenzene carboximidamide

2-(3-bromophenyl)-1H-imidazole

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