Molecule

ID:129808

General Information
Structure
MolImage
Molecular Formula
CN₄O₈
Molecular Mass
196.0327
Exact Mass
195.97161298
Charge
0
InChI
InChI=1S/CN4O8/c6-2(7)1(3(8)9,4(10)11)5(12)13
InChIKey
NYTOUQBROMCLBJ-UHFFFAOYSA-N
Canonic Smiles
[O-][N+](=O)C([N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-]
Isomeric Smiles
C([N+](=O)[O-])([N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-]
Calculated Properties
JChem
H Acceptors
8
H Donor
0
LogD (pH = 5.5)
0.8945341
LogD (pH = 7.4)
0.8945341
Log P
0.8945341
Molar Refractivity
29.8674
Polarizability
11.429664
Polar Surface Area
183.28
Rotatable Bonds
4
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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