CID 24186721
PubChem CID
24186721
Structure
Preferred Compound
Molecular Formula
Status
Non-live
Molecular Weight
283.26 g/mol
Dates
- Create:2008-02-29
Chemical Structure Depiction
InChI=1S/C10H12O6S.Na/c1-3-15-9(13)7-5(11)6(12)8(17-7)10(14)16-4-2;/h13-14H,3-4H2,1-2H3;/b9-7-,10-8-;
DASUMFQYOIQEAS-RMMOYNDYSA-N
CCO/C(=C/1\S/C(=C(\OCC)/O)/C(=O)C1=O)/O.[Na]
C10H12NaO6S
Property Name
Property Value
Reference
Property Name
Molecular Weight
Property Value
283.26 g/mol
Property Name
Hydrogen Bond Donor Count
Property Value
2
Property Name
Hydrogen Bond Acceptor Count
Property Value
7
Property Name
Rotatable Bond Count
Property Value
4
Property Name
Exact Mass
Property Value
283.02522855 g/mol
Property Name
Monoisotopic Mass
Property Value
283.02522855 g/mol
Property Name
Topological Polar Surface Area
Property Value
118 A^2
Property Name
Heavy Atom Count
Property Value
18
Property Name
Formal Charge
Property Value
0
Property Name
Complexity
Property Value
371
Property Name
Isotope Atom Count
Property Value
0
Property Name
Defined Atom Stereocenter Count
Property Value
0
Property Name
Undefined Atom Stereocenter Count
Property Value
0
Property Name
Defined Bond Stereocenter Count
Property Value
2
Property Name
Undefined Bond Stereocenter Count
Property Value
0
Property Name
Covalently-Bonded Unit Count
Property Value
2
Property Name
Compound Is Canonicalized
Property Value
Yes
Old substance
CONTENTS