Molecule

ID:136008

General Information
Structure
MolImage
Molecular Formula
C₃H₆O₃
Molecular Mass
93.05590451
Exact Mass
93.04175857
Charge
0
InChI
InChI=1S/C3H6O3/c1-5-3(4)6-2/h1-2H3/i1+1,2+1,3+1
InChIKey
IEJIGPNLZYLLBP-VMIGTVKRSA-N
Canonic Smiles
[13CH3]O[13C](=O)O[13CH3]
Isomeric Smiles
[13CH3]O[13C](=O)O[13CH3]
Calculated Properties
JChem
H Acceptors
2
H Donor
0
LogD (pH = 5.5)
0.5418395
LogD (pH = 7.4)
0.5418395
Log P
0.5418395
Molar Refractivity
19.0364
Polarizability
7.834368
Polar Surface Area
35.53
Rotatable Bonds
2
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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