Nsc229494 structure

Nsc229494

2-(benzenesulfonyl)-2-methylsulfonylacetonitrile

Also Known As: (METHYLSULFONYL)(PHENYLSULFONYL)ACETONITRILE|2-(benzenesulfonyl)-2-methylsulfonylacetonitrile|(Benzenesulfonyl)(methanesulfonyl)acetonitrile|2-(benzenesulfonyl)-2-methanesulfonylacetonitrile|651-670-1

CAS: 56075-42-4
Molecular Formula C9H9NO4S2
Molecular Weight 258.9973 g/mol
LogP 0.5
Topological Polar Surface Area 109.0 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 5
Rotatable Bonds 3
Exact Mass 258.9973
Monoisotopic Mass 258.9973
Heavy Atoms 16
Complexity 480.0

Chemical Identifiers

CAS Number 56075-42-4
SMILES CS(=O)(=O)C(C#N)S(=O)(=O)C1=CC=CC=C1
InChIKey AEOQDPYDVGUUMY-UHFFFAOYSA-N

Product Overview

Nsc229494 (CAS 56075-42-4), with molecular formula C9H9NO4S2 and molecular weight 258.9973 g/mol. IUPAC: 2-(benzenesulfonyl)-2-methylsulfonylacetonitrile.

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