Structure

InChI Key CIHOLLKRGTVIJN-UHFFFAOYSA-N
Smiles CC(C)(C)OO
InChI
InChI=1S/C4H10O2/c1-4(2,3)6-5/h5H,1-3H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C4H10O2
Molecular Weight 90.07
AlogP 1.27
Hydrogen Bond Acceptor 2.0
Hydrogen Bond Donor 1.0
Polar Surface Area 29.46
Heavy Atoms 6.0

Cross References

Resources Reference
CAS NUMBER 75-91-2
NORMAN SUSDAT
FDA SRS 955VYL842B
PubChem 6410
ChemSpider 6170.0