Molecule

ID:103651

General Information
Structure
MolImage
Molecular Formula
C₃H₆O₃
Molecular Mass
90.07794
Exact Mass
90.03169405
Charge
0
InChI
InChI=1S/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)
InChIKey
JVTAAEKCZFNVCJ-UHFFFAOYSA-N
Canonic Smiles
OC(=O)C(O)C
Isomeric Smiles
CC(O)C(=O)O
Calculated Properties
JChem
LogD (pH = 7.4)
-3.74
LogD (pH = 5.5)
-2.19
Log P
-0.47
Rotatable Bonds
1
H Donor
2
H Acceptors
3
Lipinski's Rule of Five
true
Acid pKa
3.78
Polar Surface Area
57.53
Polarizability
8.06
Molar Refractivity
18.84
LOG S
0.37
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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