1-chloro-4-methylsulfonyl-2-nitrobenzene

CAS: 97-07-4

Molecular Formula	`C7H6ClNO4S`
Molecular Weight	235.65 g/mol
LogP	1.5
Topological Polar Surface Area	88.3 A2
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	4
Rotatable Bonds	1
Exact Mass	234.97061
Heavy Atoms	14
Complexity	318.0

Chemical Identifiers

CAS Number	97-07-4
SMILES	`CS(=O)(=O)C1=CC(=C(C=C1)Cl)[N+](=O)[O-]`
InChIKey	`JAANTSGNTKWLFA-UHFFFAOYSA-N`

📖 Product Overview

1-chloro-4-methylsulfonyl-2-nitrobenzene (CAS: 97-07-4) is a chemical compound with molecular formula C7H6ClNO4S and molecular weight 235.65 g/mol. Its IUPAC systematic name is 1-chloro-4-methylsulfonyl-2-nitrobenzene. LogP 1.5 Topological Polar Surface Area 88.3 A2 Hydrogen Bond Donors 0 Hydrogen Bond Acceptors 4 Rotatable Bonds 1 Exact Mass 234.97061 Heavy Atoms 14 Complexity 318.0 InChI Key: JAANTSGNTKWLFA-UHFFFAOYSA-N. SMILES: CS(=O)(=O)C1=CC(=C(C=C1)Cl)[N+](=O)[O-].

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