Molecule

ID:136286

General Information
Structure
MolImage
Molecular Formula
C₅H₁₀O₂
Molecular Mass
103.12435484
Exact Mass
103.0714344
Charge
0
InChI
InChI=1S/C5H10O2/c1-3-5(6)7-4-2/h3-4H2,1-2H3/i5+1
InChIKey
FKRCODPIKNYEAC-HOSYLAQJSA-N
Canonic Smiles
CCO[13C](=O)CC
Isomeric Smiles
CC[13C](=O)OCC
Calculated Properties
JChem
H Acceptors
1
H Donor
0
LogD (pH = 5.5)
0.97989213
LogD (pH = 7.4)
0.97989213
Log P
0.97989213
Molar Refractivity
26.7883
Polarizability
10.71875
Polar Surface Area
26.3
Rotatable Bonds
3
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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