Ethane-1,1,1-d3
C₂H₆·33.090 g/mol·CID 137287
IUPAC: 1,1,1-trideuterioethane
Also known as: 2031-95-0, DTXSID50174200, RefChem:138136, DTXCID0096691, 1,1,1-trideuterioethane (+4 more)
Molecular Structure
Molecular Propertiesmass · H-bonds · stereo
Molecular Weight
33.090g/mol
Exact Mass
33.065780Da
Monoisotopic Mass
33.065780Da
XLogP
1.3
Polar Surface Area
0.0Ų
Complexity
0
Formal Charge
0
H-Bond Donors
0
H-Bond Acceptors
0
Rotatable Bonds
0
Heavy Atoms
2
Stereo Centers
0
Bond Stereo
0
Drug-Likeness (Lipinski's Rule of Five)
✓ 33.1 g/mol
MW ≤ 500
✓ 1.3
LogP ≤ 5
✓ 0
H-bond donors ≤ 5
✓ 0
H-bond acceptors ≤ 10
Passes all rules — good oral bioavailability predicted
Isomers8 compounds with formula C₂H₆
ethane
CID 6324 · 30.1 g/mol
1,1,1,2,2,2-hexadeuterioethane
CID 137127 · 36.1 g/mol
deuterioethane
CID 138525 · 31.1 g/mol
1,1,1,2,2-pentadeuterioethane
CID 12053198 · 35.1 g/mol
1,1,2,2-tetradeuterioethane
CID 15244547 · 34.1 g/mol
tritioethane
CID 22844667 · 32.1 g/mol
1,1-dideuterioethane
CID 141449 · 32.1 g/mol
(113C)ethane
CID 12053733 · 31.1 g/mol