Benzoic acid, 2-chloro-5-(((1-methylethoxy)thioxomethyl)amino)-, 1-ethylpropyl ester

Base Information

• Chemical Name: Benzoic acid, 2-chloro-5-(((1-methylethoxy)thioxomethyl)amino)-, 1-ethylpropyl ester
• CAS No.: 135813-27-3
• Molecular Formula: C16H22ClNO3S
• Molecular Weight: 343.8688
• DSSTox Substance ID: DTXSID20159569

Synonyms:135813-27-3;Benzoic acid, 2-chloro-5-(((1-methylethoxy)thioxomethyl)amino)-, 1-ethylpropyl ester;Benzoic acid, 2-chloro-5-[[(1-methylethoxy)thioxomethyl]amino]-, 1-ethylpropyl ester;DTXSID20159569;1-ethylpropyl 2-chloro-5-(isopropoxycarbothioylamino)benzoate

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

Chemical Property:

• Vapor Pressure: 5.14E-07mmHg at 25°C
• Boiling Point: 412.5°Cat760mmHg
• Flash Point: 203.3°C
• Density: 1.2g/cm³
• XLogP3: 5.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 8
• Exact Mass: 343.1008924
• Heavy Atom Count: 22
• Complexity: 374

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: CCC(CC)OC(=O)C1=C(C=CC(=C1)NC(=S)OC(C)C)Cl

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