2-Bromo-1-(5-methyl-2-phenyloxazol-4-yl)ethanone

Base Information

• Chemical Name: 2-Bromo-1-(5-methyl-2-phenyloxazol-4-yl)ethanone
• CAS No.: 103788-62-1
• Molecular Formula: C12H10BrNO2
• Molecular Weight: 280.121
• European Community (EC) Number: 869-552-5
• Mol file: 103788-62-1.mol

Synonyms:103788-62-1;2-bromo-1-(5-methyl-2-phenyloxazol-4-yl)ethanone;2-bromo-1-(5-methyl-2-phenyl-1,3-oxazol-4-yl)ethan-1-one;2-bromo-1-(5-methyl-2-phenyl-1,3-oxazol-4-yl)ethanone;2-phenyl-4-bromoacetyl-5-methyloxazole;SCHEMBL3093844;RSBWHTQEZHZARK-UHFFFAOYSA-N;4-bromoacetyl-5-methyl-2-phenyloxazole;D78790;EN300-11745232;2-bromo-1-(5-methyl-2-phenyl-oxazol-4-yl)-ethanone;2-Bromo-1-(5-methyl-2-phenyloxazol-4-yl)ethan-1-one;4-(2-bromo-1-oxoethyl)-5-methyl-2-phenyl-1,3-oxazole

Chemical Property of 2-Bromo-1-(5-methyl-2-phenyloxazol-4-yl)ethanone

Chemical Property:

• PSA: 43.10000
• LogP: 3.22760
• XLogP3: 3.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 278.98949
• Heavy Atom Count: 16
• Complexity: 253

Purity/Quality:

98% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(N=C(O1)C2=CC=CC=C2)C(=O)CBr

Technology Process of 2-Bromo-1-(5-methyl-2-phenyloxazol-4-yl)ethanone

There total 5 articles about 2-Bromo-1-(5-methyl-2-phenyloxazol-4-yl)ethanone 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: 92.0%

4-acetyl-5-methyl-2-phenyloxazole (2940-19-4) → 4-bromoacetyl-5-methyl-2-phenyl-oxazole (103788-62-1)

Guidance literature:

With bromine; In chloroform; at 55 ℃; for 0.5h;

DOI:10.1021/jm00092a012

Reference yield:

5-bromosalicyclaldehyde (1761-61-1) → 4-bromoacetyl-5-methyl-2-phenyl-oxazole (103788-62-1)

Guidance literature:

With sodium methylate; In ethanol;

Reference yield:

Isonitrosoacetylacetone (29917-12-2) → 4-bromoacetyl-5-methyl-2-phenyl-oxazole (103788-62-1)

Guidance literature:

Multi-step reaction with 3 steps

1: hydrogenchloride; acetic acid

2: acetic acid; zinc

3: bromine / chloroform

With hydrogenchloride; bromine; acetic acid; zinc; In chloroform;

DOI:10.1016/j.mencom.2014.09.010

upstream raw materials:

4-acetyl-5-methyl-2-phenyloxazole

5-bromosalicyclaldehyde

benzaldehyde

Isonitrosoacetylacetone

Downstream raw materials:

4-<2-hydroxy-2-(5-methyl-2-phenyl-4-oxazolyl)oxoehtoxy>acetanilide

(5-bromo-2-benzofuranyl)(5-methyl-2-phenyl-4-oxazolyl)methanone

(5-methyl-2-phenyloxazol-4-yl)(5-nitrobenzofuran-2-yl)methanone

2-[(2-Phenyl-5-methyloxazol-4-yl)methyl]-5-bromobenzofuran