2-Methyl-4-oxo-pentane-2-sulfonic acid structure

2-Methyl-4-oxo-pentane-2-sulfonic acid

2-methyl-4-oxopentane-2-sulfonic acid

Also Known As: 2-methyl-4-oxo-pentane-2-sulfonic acid|2-methyl-4-oxopentane-2-sulfonic acid|2-Methyl-4-oxo-2-pentanesulfonic acid|2-methyl-4-oxopentane-2-sulfonic acid acid|J3.466.576A

CAS: 67779-47-9
Molecular Formula C6H12O4S
Molecular Weight 180.04562 g/mol
LogP -0.6
Topological Polar Surface Area 79.8 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 4
Rotatable Bonds 3
Exact Mass 180.04562
Monoisotopic Mass 180.04562
Heavy Atoms 11
Complexity 244.0

Chemical Identifiers

CAS Number 67779-47-9
SMILES CC(=O)CC(C)(C)S(=O)(=O)O
InChIKey CDLJPDXATJWHDX-UHFFFAOYSA-N

Product Overview

2-Methyl-4-oxo-pentane-2-sulfonic acid (CAS 67779-47-9), with molecular formula C6H12O4S and molecular weight 180.04562 g/mol. IUPAC: 2-methyl-4-oxopentane-2-sulfonic acid.

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