1 2D Structure

2D Structure

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

methylsulfonylmethane;carbonate

2.1.2 InChI

InChI=1S/C2H6O2S.CH2O3/c1-5(2,3)4;2-1(3)4/h1-2H3;(H2,2,3,4)/p-2

2.1.3 InChI Key

QNSCEFIVYQYCRC-UHFFFAOYSA-L

2.1.4 Canonical SMILES

CS(=O)(=O)C.C(=O)([O-])[O-]

2.2 Create Date

2007-12-05

3 Chemical and Physical Properties

Molecular Formula	C₃H₆O₅S-₂
Molecular Weight	154.14 g/mol
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	0
Exact Mass	153.99359446 g/mol
Monoisotopic Mass	153.99359446 g/mol
Topological Polar Surface Area	106 Å²
Heavy Atom Count	9
Formal Charge	-2
Complexity	104
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	2

Methylsulfonylmethane;Carbonate