Molecule

ID:128773

General Information
Structure
MolImage
Molecular Formula
C₃H₆O
Molecular Mass
58.07914
Exact Mass
58.04186481
Charge
0
InChI
InChI=1S/C3H6O/c1-2-4-3-1/h1-3H2
InChIKey
AHHWIHXENZJRFG-UHFFFAOYSA-N
Canonic Smiles
C1CCO1
Isomeric Smiles
C1CCO1
Calculated Properties
JChem
LogD (pH = 7.4)
0.01
LogD (pH = 5.5)
0.01
Log P
0.01
Rotatable Bonds
0
H Donor
0
H Acceptors
1
Lipinski's Rule of Five
true
Acid pKa
-4.12
Polar Surface Area
9.23
Polarizability
6.40
Molar Refractivity
15.91
LOG S
0.07
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
No Data Available
Click here to submit data
Molecular Spectra
No Data Available
Click here to submit data
Molecule Details
References
Bioactivity
Navigation