Structure

InChI Key DDFZXEVRGBYWSN-UHFFFAOYSA-N
Smiles O=C(OC(C)S(=O)(=O)O)C(=C)C
InChI
InChI=1/C6H10O5S/c1-4(2)6(7)11-5(3)12(8,9)10/h5H,1H2,2-3H3,(H,8,9,10)

Physicochemical Descriptors

Property Name Value
Molecular Formula C6H10O5S
Molecular Weight 194.02
AlogP 0.34
Hydrogen Bond Acceptor 4.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 3.0
Polar Surface Area 80.67
Heavy Atoms 12.0

Cross References

Resources Reference
CAS NUMBER 10595-80-9
NORMAN SUSDAT
PubChem 19013195
ChemSpider 10764233.0