Molecule

ID:3943

General Information
Structure
MolImage
Molecular Formula
C₂H₂O₃
Molecular Mass
74.03548
Exact Mass
74.00039392
Charge
0
InChI
InChI=1S/C2H2O3/c3-1-2(4)5/h1H,(H,4,5)
InChIKey
HHLFWLYXYJOTON-UHFFFAOYSA-N
Canonic Smiles
O=CC(=O)O
Isomeric Smiles
OC(=O)C=O
Calculated Properties
JChem
LogD (pH = 7.4)
-3.64
LogD (pH = 5.5)
-2.94
Log P
-0.13
Rotatable Bonds
1
H Donor
1
H Acceptors
3
Lipinski's Rule of Five
true
Acid pKa
2.61
Polar Surface Area
54.37
Polarizability
5.35
Molar Refractivity
13.50
LOG S
0.58
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
Molecular Spectra
No Data Available
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Molecule Details
References
Bioactivity
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