Cartox
C₃H₄O₃·88.060 g/mol·CID 197111
IUPAC: carbon dioxide;oxirane
Also known as: Leutox, Fumigen 10, RefChem:1085193, Ethylene oxide-carbon dioxide mixture, Oxirane, mixt. with carbon dioxide (+9 more)
Molecular Structure
Molecular Propertiesmass · H-bonds · stereo
Molecular Weight
88.060g/mol
Exact Mass
88.016044Da
Monoisotopic Mass
88.016044Da
XLogP
—
Polar Surface Area
46.7Ų
Complexity
28
Formal Charge
0
H-Bond Donors
0
H-Bond Acceptors
3
Rotatable Bonds
0
Heavy Atoms
6
Stereo Centers
0
Bond Stereo
0
Drug-Likeness (Lipinski's Rule of Five)
✓ 88.1 g/mol
MW ≤ 500
? —
LogP ≤ 5
✓ 0
H-bond donors ≤ 5
✓ 3
H-bond acceptors ≤ 10
Passes all rules — good oral bioavailability predicted