Acetic acid, ((2-nitrophenyl)sulfonyl)-, 1-methylethyl ester

Base Information

• Chemical Name: Acetic acid, ((2-nitrophenyl)sulfonyl)-, 1-methylethyl ester
• CAS No.: 139326-51-5
• Molecular Formula: C11H13NO6S
• DSSTox Substance ID: DTXSID50876419
• Nikkaji Number: J696.272F
• Wikidata: Q82858050
• Mol file: 139326-51-5.mol

Synonyms:139326-51-5;Acetic acid, ((2-nitrophenyl)sulfonyl)-, 1-methylethyl ester;DTXSID50876419;AKOS003633922;2-Nitrophenylsulfonyl-acetic acid, isopropyl est;2-(2-Nitrophenylsulfonyl)acetic acid isopropyl ester

Chemical Property of Acetic acid, ((2-nitrophenyl)sulfonyl)-, 1-methylethyl ester

Chemical Property:

• XLogP3: 1.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 5
• Exact Mass: 287.04635831
• Heavy Atom Count: 19
• Complexity: 433

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

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