TETRAHYDROCYCLOBUTA(1,2-C:3,4-C')DIFURAN-1,3,4,6-TETRAONE

/static/temp/default.svg Search structure
Keyword(s): Human Metabolites
Molecule Category Free-form
UNII P1DOQ7P28N
EPA CompTox DTXSID00196058

Structure

InChI Key YGYCECQIOXZODZ-UHFFFAOYSA-N
Smiles O=C1OC(=O)C2C1C1C2C(=O)OC1=O
InChI
InChI=1S/C8H4O6/c9-5-1-2(6(10)13-5)4-3(1)7(11)14-8(4)12/h1-4H/t1-,2+,3+,4-

Physicochemical Descriptors

Property Name Value
Molecular Formula C8H4O6
Molecular Weight 196.0
AlogP -1.37
Hydrogen Bond Acceptor 6.0
Polar Surface Area 86.74
Heavy Atoms 14.0

Cross References

Resources Reference
CAS NUMBER 4415-87-6
NORMAN SUSDAT
FDA SRS P1DOQ7P28N
PubChem 107280
ChemSpider 96545.0
CONTENTS