Compound Information
CID 6093651
Create Date: 2006-03-21
Suppressed Compound
Properties and Descriptors
Properties
Molecular Weight 200.188029 [g/mol]
Molecular FormulaC6H9NaO4S
H-Bond Donor0
H-Bond Acceptor4
Rotatable Bond Count0
Exact Mass200.011924
MonoIsotopic Mass200.011924
Topological Polar Surface Area82.6
Heavy Atom Count12
Formal Charge0
Complexity235
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Descriptors
IUPAC Name
Canonical SMILES
Isomeric SMILES
Old Version Substance Information