Acetic acid, ((4-chloro-2-nitrophenyl)thio)-, 1-methylethyl ester

Base Information

• Chemical Name: Acetic acid, ((4-chloro-2-nitrophenyl)thio)-, 1-methylethyl ester
• CAS No.: 139359-10-7
• Molecular Formula: C11H12ClNO4S
• DSSTox Substance ID: DTXSID50876338
• Nikkaji Number: J696.255F
• Wikidata: Q82857953
• Mol file: 139359-10-7.mol

Synonyms:139359-10-7;Acetic acid, ((4-chloro-2-nitrophenyl)thio)-, 1-methylethyl ester;DTXSID50876338;4-Chloro-2-nitrophenylthio-acetic acid, isopropy

Chemical Property of Acetic acid, ((4-chloro-2-nitrophenyl)thio)-, 1-methylethyl ester

Chemical Property:

• XLogP3: 3.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 5
• Exact Mass: 289.0175567
• Heavy Atom Count: 18
• Complexity: 308

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC(C)OC(=O)CSC1=C(C=C(C=C1)Cl)[N+](=O)[O-]