Benzoic acid, 2-chloro-5-(((2-methylphenyl)thioxomethyl)amino)-, 1-methylethyl ester

Base Information

• Chemical Name: Benzoic acid, 2-chloro-5-(((2-methylphenyl)thioxomethyl)amino)-, 1-methylethyl ester
• CAS No.: 135812-55-4
• Molecular Formula: C18H18ClNO2S
• Molecular Weight: 347.859
• DSSTox Substance ID: DTXSID20159549

Synonyms:135812-55-4;Benzoic acid, 2-chloro-5-(((2-methylphenyl)thioxomethyl)amino)-, 1-methylethyl ester;Benzoic acid, 2-chloro-5-[[(2-methylphenyl)thioxomethyl]amino]-, 1-methylethyl ester;DTXSID20159549;isopropyl 2-chloro-5-[(2-methylbenzenecarbothioyl)amino]benzoate

Chemical Property of Benzoic acid, 2-chloro-5-(((2-methylphenyl)thioxomethyl)amino)-, 1-methylethyl ester

Chemical Property:

• Vapor Pressure: 1.29E-08mmHg at 25°C
• Boiling Point: 459.2°Cat760mmHg
• Flash Point: 231.5°C
• Density: 1.261g/cm³
• XLogP3: 5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 5
• Exact Mass: 347.0746777
• Heavy Atom Count: 23
• Complexity: 429

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC=CC=C1C(=S)NC2=CC(=C(C=C2)Cl)C(=O)OC(C)C

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