Structure

InChI Key JIBLHSNEQAYSEY-UHFFFAOYSA-N
Smiles [Mn].CCCC(O)=O
InChI
InChI=1/C4H8O2.Mn/c1-2-3-4(5)6;/h2-3H2,1H3,(H,5,6);/q;+2

Physicochemical Descriptors

Property Name Value
Molecular Formula C4H8O2.xMn
Molecular Weight 142.99
AlogP 0.87
Hydrogen Bond Acceptor 1.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 2.0
Polar Surface Area 37.3
Heavy Atoms 7.0

Cross References

Resources Reference
CAS NUMBER 19664-95-0
NORMAN SUSDAT