18983-82-9
CO₂·48.009 g/mol·CID 12130228
IUPAC: methanedi(18O2)one
Also known as: Carbon dioxide-18O2, RefChem:574318, 629-672-9, Carbon-12C dioxide-18O2, SCHEMBL1331757 (+4 more)
Molecular Structure
Molecular Propertiesmass · H-bonds · stereo
Molecular Weight
48.009g/mol
Exact Mass
47.998319Da
Monoisotopic Mass
47.998319Da
XLogP
0.9
Polar Surface Area
34.1Ų
Complexity
18
Formal Charge
0
H-Bond Donors
0
H-Bond Acceptors
2
Rotatable Bonds
0
Heavy Atoms
3
Stereo Centers
0
Bond Stereo
0
Drug-Likeness (Lipinski's Rule of Five)
✓ 48.0 g/mol
MW ≤ 500
✓ 0.9
LogP ≤ 5
✓ 0
H-bond donors ≤ 5
✓ 2
H-bond acceptors ≤ 10
Passes all rules — good oral bioavailability predicted
GHS Hazard Classification
Warning
Hazards
H280Contains gas under pressure; may explode if heated
Source: PubChem GHS Classification. Always consult the SDS for handling.