Molecular Identity
Isopropanol
propan-2-ol
PubChem CID: 3776
Propan-2-ol is a secondary alcohol that is propane in which one of the hydrogens attached to the central carbon is substituted by a hydroxy group. It has a role as a protic solvent. It is a secondary fatty alcohol and a secondary alcohol.
2D Structure
Properties
C3H8O
Molecular Formula
60.10
Molecular Weight
g/mol
60.0575
Exact Mass
Da
0.3
XLogP
Drug-like (Lipinski: < 5)
20.2
TPSA
Good oral absorption (< 140 A²)
1
H-Bond Donors
1
H-Bond Acceptors
10
Complexity
SMILES
Canonical SMILES
SMILES: CC(C)OIsomeric SMILES
SMILES: CC(C)OSynonyms(20)
Isopropyl alcoholisopropanol2-PropanolPropan-2-ol67-63-02-HydroxypropaneDimethylcarbinolsec-Propyl alcoholAlkolaveAvantineHartosolPetroholi-Propanol1-MethylethanolTakineocol
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to Isopropanol
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