1-Chloro-N,N-dimethyl-1-phenylboranamine

Base Information

• Chemical Name: 1-Chloro-N,N-dimethyl-1-phenylboranamine
• CAS No.: 1196-44-7
• Molecular Formula: C8H11BClN
• Molecular Weight: 167.446
• Hs Code.: 2931900090
• DSSTox Substance ID: DTXSID10498732
• Nikkaji Number: J113.133H
• Wikidata: Q82348966
• Mol file: 1196-44-7.mol

Synonyms:1-Chloro-N,N-dimethyl-1-phenylboranamine;1196-44-7;N-[chloro(phenyl)boranyl]-N-methylmethanamine;Chloro(dimethylamino)phenylborane;SCHEMBL8966998;DTXSID10498732;chloro( dimethylamino )phenylborane

Chemical Property of 1-Chloro-N,N-dimethyl-1-phenylboranamine

Chemical Property:

• PSA: 3.24000
• LogP: 1.18220
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 167.0673072
• Heavy Atom Count: 11
• Complexity: 113

Purity/Quality:

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

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: B(C1=CC=CC=C1)(N(C)C)Cl

Technology Process of 1-Chloro-N,N-dimethyl-1-phenylboranamine

There total 13 articles about 1-Chloro-N,N-dimethyl-1-phenylboranamine 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: 96.0%

phenylborondichloride (873-51-8) + Bis-(dimethylamino)-phenylboran (1201-45-2) → chloro(dimethylamino)phenylborane (1196-44-7)

Guidance literature:

(dichloro)phenylborane was added to bis(dimethylamino)phenylborane keeping the temp. at 60-70°C, stirred for 30 min; destn.;

Reference yield: 94.1%

({(CH3)2NH}2B(Cl)C6H5)(1+)*Cl(1-)=({(CH3)2NH}2B(Cl)C6H5)Cl (94947-35-0) → chloro(dimethylamino)phenylborane (1196-44-7) + N,N-dimethylammonium chloride (506-59-2)

Guidance literature:

In neat (no solvent); pyrolysis from 150 to 200°C;;

Reference yield: 94.0%

phenylborondichloride (873-51-8) → chloro(dimethylamino)phenylborane (1196-44-7)

Guidance literature:

With dimethyl amine; In benzene; 150-200°C;

upstream raw materials:

tetrakis(dimethylamido)diborane

diphenylboronchloride

Dimethyl-(1,2,4,5-tetramethyl-[1,2,4,3,5]triazadiborolidin-3-yl)-amine

phenylborondichloride

Downstream raw materials:

-methyl-phenyl-boran

C₁₂H₂₀BN₃O

C₁₆H₁₇BCl₂N₂O

C₁₆H₁₈BClN₂O