Molecule

ID:136185

General Information
Structure
MolImage
Molecular Formula
C₃H₈O
Molecular Mass
61.0947517
Exact Mass
61.06173196
Charge
0
InChI
InChI=1S/C3H8O/c1-3(2)4/h3-4H,1-2H3/i4+1
InChIKey
KFZMGEQAYNKOFK-AZXPZELESA-N
Canonic Smiles
CC([17OH])C
Isomeric Smiles
CC(C)[17OH]
Calculated Properties
JChem
Acid pKa
17.262587
H Acceptors
1
H Donor
1
LogD (pH = 5.5)
0.2548059
LogD (pH = 7.4)
0.25480592
Log P
0.25480592
Molar Refractivity
17.4287
Polarizability
6.874204
Polar Surface Area
20.23
Rotatable Bonds
0
Lipinski's Rule of Five
true
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
No Data Available
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Molecular Spectra
No Data Available
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Molecule Details
References
Bioactivity
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