3-Acetylbenzoyl chloride

Base Information

Chemical Name:3-Acetylbenzoyl chloride
CAS No.:31076-85-4
Molecular Formula:C9H7ClO2
Molecular Weight:182.606
Hs Code.:2916399090
DSSTox Substance ID:DTXSID70550365
Nikkaji Number:J456.473A
Wikidata:Q82429669
Mol file:31076-85-4.mol

Synonyms:3-acetylbenzoyl chloride;31076-85-4;Benzoyl chloride, 3-acetyl- (9CI);SCHEMBL5254838;DTXSID70550365;MFCD13174028

Suppliers and Price of 3-Acetylbenzoyl chloride

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

TRC
3-AcetylbenzoylChloride
250mg
$ 95.00

Matrix Scientific
3-Acetylbenzoylchloride 95%
1g
$ 672.00

Atlantic Research Chemicals
3-Acetylbenzoylchloride 95%
1gm:
$ 279.23

Apolloscientific
3-Acetylbenzoylchloride
1g
$ 450.00

Total 4 raw suppliers

Chemical Property of 3-Acetylbenzoyl chloride

Chemical Property:

PSA：34.14000
LogP:2.26820
XLogP3:2.5
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:182.0134572
Heavy Atom Count:12
Complexity:201

Purity/Quality:

99%, ^*data from raw suppliers

3-AcetylbenzoylChloride ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(=O)C1=CC(=CC=C1)C(=O)Cl
Uses 3-Acetylbenzoyl Chloride is used in the synthesis of aminimdes as potential CNS acting agents. Also, it is an intermediate used in the synthesis of 3-[(Dimethylamino)carbonyl]phenol (D461635), which can be used in the synthesis of novel purine and bicyclic pyrimidine, which are factor Xa inhibitors, and also have high selectivity over thrombin and trypsin.

Technology Process of 3-Acetylbenzoyl chloride

There total 2 articles about 3-Acetylbenzoyl chloride 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: