N-[(1R)-1-(4-bromophenyl)ethyl]acetamide

Base Information

• Chemical Name: N-[(1R)-1-(4-bromophenyl)ethyl]acetamide
• CAS No.: 177750-53-7
• Molecular Formula: C10H12BrNO
• Molecular Weight: 242.115
• DSSTox Substance ID: DTXSID20355185
• Nikkaji Number: J1.962.628H
• Wikidata: Q82133908
• Mol file: 177750-53-7.mol

Synonyms:177750-53-7;(R)-N-(1-(4-Bromophenyl)ethyl)acetamide;(R)N-[1-(4-Bromo-phenyl)-ethyl]-acetamide;N-[(1R)-1-(4-bromophenyl)ethyl]acetamide;SCHEMBL255664;DTXSID20355185;DRRCKKJEBGEBGR-SSDOTTSWSA-N;AKOS019933003

Chemical Property of N-[(1R)-1-(4-bromophenyl)ethyl]acetamide

Chemical Property:

• XLogP3: 2.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 241.01023
• Heavy Atom Count: 13
• Complexity: 176

Purity/Quality:

98%Min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C1=CC=C(C=C1)Br)NC(=O)C
• Isomeric SMILES: C[C@H](C1=CC=C(C=C1)Br)NC(=O)C

Technology Process of N-[(1R)-1-(4-bromophenyl)ethyl]acetamide

There total 21 articles about N-[(1R)-1-(4-bromophenyl)ethyl]acetamide 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%

N-{1-(4-bromophenyl)vinyl}acetamide (177750-12-8) → N-[(1R)-1-(4-bromophenyl)ethyl]acetamide (177750-53-7)

Guidance literature:

With bis(1,5-cyclooctadiene)rhodium(I) tetrafluoroborate; C₄₆H₃₄O₆P₂; hydrogen; In dichloromethane; at 25 ℃; for 6h; enantioselective reaction; Autoclave; Inert atmosphere;

DOI:10.1007/s10562-017-1986-8

Reference yield: 100.0%

(R)-1-(4-bromophenyl)ethylamine (24358-62-1,27298-97-1,45791-36-4,64313-06-0) + acetic anhydride (108-24-7) → N-[(1R)-1-(4-bromophenyl)ethyl]acetamide (177750-53-7)

Guidance literature:

With pyridine; In dichloromethane; at 25 ℃; for 3h;

Reference yield: 87.0%

(R)-N-(1-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)ethyl)acetamide (1260955-13-2) → N-[(1R)-1-(4-bromophenyl)ethyl]acetamide (177750-53-7)

Guidance literature:

With N-Bromosuccinimide; copper(I) bromide; In acetonitrile; at 80 ℃; for 12h;

DOI:10.1016/j.tetasy.2010.09.011

upstream raw materials:

N-{1-(4-bromophenyl)vinyl}acetamide

Isopropyl acetate

1-(4-bromophenyl)ethylamine

4-bromophenyl trifluoromethanesulfonate

Downstream raw materials:

N-((R)-1-(4-cyanophenyl)ethyl)acetamide

(R)-4'-methyl-1-phenylethylamine

C₂₄H₂₃N₅O₂

(R)-N-(1-(4-(6-bromo-8-methoxyquinazolin-2-ylamino)-phenyl)ethyl)acetamide