Molecule

ID:69998

General Information
Structure
MolImage
Molecular Formula
C₄H₉NO₂
Molecular Mass
103.11976
Exact Mass
103.06332853
Charge
0
InChI
InChI=1S/C4H9NO2/c1-4(6)5(2)7-3/h1-3H3
InChIKey
OYVXVLSZQHSNDK-UHFFFAOYSA-N
Canonic Smiles
CON(C(=O)C)C
Isomeric Smiles
C(=O)(C)N(C)OC
Calculated Properties
JChem
H Acceptors
2
H Donor
0
LogD (pH = 5.5)
-0.43183327
LogD (pH = 7.4)
-0.43183327
Log P
-0.43183327
Molar Refractivity
25.6095
Polarizability
10.050503
Polar Surface Area
29.54
Rotatable Bonds
1
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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