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

Base Information

• Chemical Name: Acetic acid, ((2-chloro-4-nitrophenyl)sulfinyl)-, 1-methylethyl ester
• CAS No.: 139326-41-3
• Molecular Formula: C11H12ClNO5S
• DSSTox Substance ID: DTXSID40874181
• Nikkaji Number: J696.260B

Synonyms:139326-41-3;Acetic acid, ((2-chloro-4-nitrophenyl)sulfinyl)-, 1-methylethyl ester;DTXSID40874181;2-Chloro-4-Nitrophenylsulfinyl-acetic acid, isop

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

Chemical Property:

• XLogP3: 2.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 5
• Exact Mass: 305.0124714
• Heavy Atom Count: 19
• Complexity: 371

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MSDS Files:

Useful:

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

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