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Technology Process of Benzoic acid, 2-chloro-5-(((2-methyl-3-furanyl)thioxomethyl)amino)-, 2-methyl-1-(1-methylethyl)propyl ester

Benzoic acid, 2-chloro-5-(((2-methyl-3-furanyl)thioxomethyl)amino)-, 2-methyl-1-(1-methylethyl)propyl ester

Base Information
  • Chemical Name:Benzoic acid, 2-chloro-5-(((2-methyl-3-furanyl)thioxomethyl)amino)-, 2-methyl-1-(1-methylethyl)propyl ester
  • CAS No.:172998-75-3
  • Molecular Formula:C20H24ClNO3S
  • Molecular Weight:393.9275
  • Hs Code.:
  • NSC Number:645548
  • UNII:MQ4W8T2SEL
  • DSSTox Substance ID:DTXSID70169491
  • ChEMBL ID:CHEMBL100708
Benzoic acid, 2-chloro-5-(((2-methyl-3-furanyl)thioxomethyl)amino)-, 2-methyl-1-(1-methylethyl)propyl ester

Synonyms:UC538;MQ4W8T2SEL;UNII-MQ4W8T2SEL;172998-75-3;NSC 645548;Benzoic acid, 2-chloro-5-(((2-methyl-3-furanyl)thioxomethyl)amino)-, 2-methyl-1-(1-methylethyl)propyl ester;NSC645548;NSC-645548;2-Chloro-5-((1-(2-methyl-furan-3-yl)-methanethioyl)-amino)-benzoic acid, 1-isopropyl-2-methyl-propyl ester;2-Methyl-1-(1-methylethyl)propyl 2-chloro-5-(((2-methyl-3-furanyl)thioxomethyl)amino)benzoate;2-Chloro-5-{[1-(2-methyl-furan-3-yl)-methanethioyl]-amino}-benzoic acid, 1-isopropyl-2-methyl-propyl ester;2-Methyl-1-(1-methylethyl)propyl 2-chloro-5-[[(2-methyl-3-furanyl)thioxomethyl]amino]benzoate;Benzoic acid, 2-chloro-5-[[(2-methyl-3-furanyl)thioxomethyl]amino]-, 2-methyl-1-(1-methylethyl)propyl ester;CHEMBL100708;DTXSID70169491;NCI60_015550;(1-isopropyl-2-methyl-propyl) 2-chloro-5-[(2-methylfuran-3-carbothioyl)amino]benzoate

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Chemical Property of Benzoic acid, 2-chloro-5-(((2-methyl-3-furanyl)thioxomethyl)amino)-, 2-methyl-1-(1-methylethyl)propyl ester
Chemical Property:
  • Vapor Pressure:3.17E-09mmHg at 25°C 
  • Boiling Point:476°Cat760mmHg 
  • Flash Point:241.7°C 
  • Density:1.211g/cm3 
  • XLogP3:6
  • Hydrogen Bond Donor Count:1
  • Hydrogen Bond Acceptor Count:4
  • Rotatable Bond Count:7
  • Exact Mass:393.1165425
  • Heavy Atom Count:26
  • Complexity:491
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MSDS Files:

SDS file from LookChem

Useful:
  • Canonical SMILES:CC1=C(C=CO1)C(=S)NC2=CC(=C(C=C2)Cl)C(=O)OC(C(C)C)C(C)C
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