2-bromo-N-(2-hydroxy-2-phenylethyl)benzamide

Base Information

• Chemical Name: 2-bromo-N-(2-hydroxy-2-phenylethyl)benzamide
• CAS No.: 380427-62-3
• Molecular Formula: C₁₅H₁₄BrNO₂
• Molecular Weight: 320.186
• DSSTox Substance ID: DTXSID201257157
• Mol file: 380427-62-3.mol

Synonyms:2-bromo-N-(2-hydroxy-2-phenylethyl)benzamide;DTXSID201257157;AKOS005885622;380427-62-3

Chemical Property of 2-bromo-N-(2-hydroxy-2-phenylethyl)benzamide

Chemical Property:

• XLogP3: 2.7
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 4
• Exact Mass: 319.02079
• Heavy Atom Count: 19
• Complexity: 292

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1=CC=C(C=C1)C(CNC(=O)C2=CC=CC=C2Br)O

Technology Process of 2-bromo-N-(2-hydroxy-2-phenylethyl)benzamide

There total 2 articles about 2-bromo-N-(2-hydroxy-2-phenylethyl)benzamide 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: 100.0%

2-bromobenzoic acid chloride (7154-66-7) + 2-Amino-1-phenylethanol (7568-93-6,1936-63-6) → 2-bromo-N-(2-hydroxy-2-phenylethyl)-benzamide (380427-62-3)

Guidance literature:

With triethylamine; In dichloromethane; for 2h;

DOI:10.1021/ja016935c

Reference yield: 63.0%

2-Amino-1-phenylethanol (7568-93-6,1936-63-6) + 2-bromobenzoic-acid (88-65-3) → 2-bromo-N-(2-hydroxy-2-phenylethyl)-benzamide (380427-62-3)

Guidance literature:

With 4-methyl-morpholine; benzotriazol-1-ol; 1,2-dichloro-ethane; In water; at 40 ℃; for 20h; chemoselective reaction; Green chemistry;

DOI:10.1021/acs.oprd.6b00133

Reference yield:

2-bromo-N-(2-hydroxy-2-phenylethyl)-benzamide (380427-62-3) → 1-(2-bromo-phenyl)isoquinoline (380427-61-2)

Guidance literature:

With phosphorus pentoxide; trichlorophosphate; In toluene; xylene; Heating;

DOI:10.1021/ja016935c

upstream raw materials:

2-bromobenzoic acid chloride

2-Amino-1-phenylethanol

2-bromobenzoic-acid

Downstream raw materials:

1-(2-bromo-phenyl)isoquinoline