Compound C12H11Cl4NO2S

2,3,5,6-tetrachloro-4-pentylsulfonylbenzonitrile

CAS: 56916-64-4

Molecular Formula	`C12H11Cl4NO2S`
Molecular Weight	375.1 g/mol
LogP	5.2
Topological Polar Surface Area	66.3 A2
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	3
Rotatable Bonds	5
Exact Mass	374.92352
Heavy Atoms	20
Complexity	454.0

Chemical Identifiers

CAS Number	56916-64-4
SMILES	`CCCCCS(=O)(=O)C1=C(C(=C(C(=C1Cl)Cl)C#N)Cl)Cl`
InChIKey	`QIWWTBJLBOJJSB-UHFFFAOYSA-N`

📖 Product Overview

Compound C12H11Cl4NO2S (CAS: 56916-64-4) is a chemical compound with molecular formula C12H11Cl4NO2S and molecular weight 375.1 g/mol. Its IUPAC systematic name is 2,3,5,6-tetrachloro-4-pentylsulfonylbenzonitrile. LogP 5.2 Topological Polar Surface Area 66.3 A2 Hydrogen Bond Donors 0 Hydrogen Bond Acceptors 3 Rotatable Bonds 5 Exact Mass 374.92352 Heavy Atoms 20 Complexity 454.0 InChI Key: QIWWTBJLBOJJSB-UHFFFAOYSA-N. SMILES: CCCCCS(=O)(=O)C1=C(C(=C(C(=C1Cl)Cl)C#N)Cl)Cl.

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