o-Tolyl-acetyl chloride

Base Information

• Chemical Name: o-Tolyl-acetyl chloride
• CAS No.: 10166-09-3
• Molecular Formula: C9H9 Cl O
• Molecular Weight: 168.623
• Hs Code.: 2933399990
• European Community (EC) Number: 673-225-0
• DSSTox Substance ID: DTXSID70375272
• Nikkaji Number: J2.181.484I
• Wikidata: Q82163799
• Mol file: 10166-09-3.mol

Synonyms:o-Tolylacetyl chloride;o-tolyl-acetyl chloride;10166-09-3;2-(2-methylphenyl)acetyl chloride;O-TOLYL-ACETYLCHLORIDE;2-o-tolylacetyl chloride;o-methylphenylacetyl chloride;2-methylphenylacetyl chloride;2-methylbenzeneacetyl chloride;SCHEMBL1150004;(2-methylphenyl)acetyl chloride;DTXSID70375272;2-methylphenylacetic acid chloride;FKMIBYMTHOJWCY-UHFFFAOYSA-N;MFCD03424714;AKOS009216063;SS-4854;(2-Methylphenyl)acetyl chloride, AldrichCPR;FT-0690309;J-000466

Chemical Property of o-Tolyl-acetyl chloride

Chemical Property:

• Boiling Point: 84℃/1.5mm
• PSA: 17.07000
• LogP: 2.30290
• Sensitive.: Moisture Sensitive
• XLogP3: 2.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 168.0341926
• Heavy Atom Count: 11
• Complexity: 145

Purity/Quality:

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

2-(2-Methylphenyl)acetylChloride ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC=CC=C1CC(=O)Cl
• Uses: 2-(2-Methylphenyl)acetyl Chloride is a useful chemical for research.

Technology Process of o-Tolyl-acetyl chloride

There total 10 articles about o-Tolyl-acetyl 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: 86.0%

Phenyl 4-amino-2-methylbenzoate (216586-23-1) → (o-tolyl)acetyl chloride (10166-09-3)

Guidance literature:

Reference yield: 86.0%

→ 3-Bromo-4-([2-methylphenyl)carbonylamino]benzoic acid + (o-tolyl)acetyl chloride (10166-09-3)

Guidance literature:

Reference yield: 75.0%

5-chloroanthranilic acid (635-21-2) → 5-Chloro-2-?(2-methylphenyl)[carbonylamino]benzoic acid + (o-tolyl)acetyl chloride (10166-09-3)

Guidance literature:

upstream raw materials:

o-methylphenylacetic acid

2-tolylmethylnitrile

2-methyl-benzyl alcohol

1-chloromethyl-2-methylbenzene

Downstream raw materials:

o-tolyl-acetic acid-(2,6-dimethyl-anilide)

1-(4-methoxyphenyl)-2-(2-methylphenyl)ethanone

2,6-dimethyl-4-[2-(2-methylphenyl)acetamido]phenyl thiocyanate

t-Butyl 2-bromo-(2-bromomethylphenyl)acetate

Refernces

• 1、 Bezen?on, Olivier,Heidmann, Bibia,Siegrist, Romain,Stamm, Simon,Richard, Sylvia,Pozzi, Davide,Corminboeuf, Olivier,Roch, Catherine,Kessler, Melanie,Ertel, Eric A.,Reymond, Isabelle,Pfeifer, Thomas,De Kanter, Ruben,Toeroek-Schafroth, Michael,Moccia, Luca G.,Mawet, Jacques,Moon, Richard,Rey, Markus,Capeleto, Bruno,Fournier, Elvire. "Discovery of a Potent, Selective T-type Calcium Channel Blocker as a Drug Candidate for the Treatment of Generalized Epilepsies". . p. 9769 - 9789. Retrieved 2017.
• 2、 Shim, Eunjae,Zakarian, Armen. "Stereoselective α-Tertiary Alkylation of N -(Arylacetyl)oxazolidinones". . p. 683 - 686. Retrieved 2020.
• 3、 Gu, Linghui,He, Meicui,Ma, Wenbo,Tan, Yuqiang,Wang, Yang,Wang, Yuchi,Zhang, Chunran. "Palladium-Catalyzed Distal C?H Selenylation of 2-Aryl Acetamides with Diselenides and Selenyl Chlorides". . p. 5708 - 5715. Retrieved 2020.
• 4、 Fang, Hai-Lian,He, Jie-Ling,Li, Wei-Yi,Liu, Shan-Shan,Ni, Wei-Wei,Pan, Xing-Ming,Xiao, Zhu-Ping,Ye, Ya-Xi,Yi, Juan,Zhou, Mi,Zhou, Tian-Li,Zhu, Hai-Liang. "N-monoarylacetothioureas as potent urease inhibitors: synthesis, SAR, and biological evaluation". . p. 404 - 413. Retrieved 2020/01/03.