Keyword(s): Food Contact Chemicals
Molecule Category Free-form
EPA CompTox DTXSID20436822

Structure

InChI Key LLWVBKQQPPRNEX-UHFFFAOYSA-N
Smiles CC(O)C(=O)OO
InChI
InChI=1S/C3H6O4/c1-2(4)3(5)7-6/h2,4,6H,1H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C3H6O4
Molecular Weight 106.03
AlogP -0.62
Hydrogen Bond Acceptor 4.0
Hydrogen Bond Donor 2.0
Number of Rotational Bond 1.0
Polar Surface Area 66.76
Heavy Atoms 7.0

Cross References

Resources Reference
CAS NUMBER 75033-25-9
NORMAN SUSDAT
PubChem 10219395