Molecule

ID:103547

General Information
Structure
MolImage
Molecular Formula
C₄H₁₃NO
Molecular Mass
91.15212
Exact Mass
91.09971404
Charge
0
InChI
InChI=1S/C4H12N.H2O/c1-5(2,3)4;/h1-4H3;1H2/q+1;/p-1
InChIKey
WGTYBPLFGIVFAS-UHFFFAOYSA-M
Canonic Smiles
C[N+](C)(C)C.[OH-]
Isomeric Smiles
[OH-].C[N+](C)(C)C
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
-3.9721673
LogD (pH = 7.4)
-3.9721673
Log P
-3.9721673
Molar Refractivity
35.9017
Polarizability
9.572162
Polar Surface Area
0.0
Rotatable Bonds
0
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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