Molecule

ID:126512

General Information
Structure
MolImage
Molecular Formula
ClNO₃
Molecular Mass
97.4579
Exact Mass
96.95667055
Charge
0
InChI
InChI=1S/ClNO3/c1-5-2(3)4
InChIKey
XYLGPCWDPLOBGP-UHFFFAOYSA-N
Canonic Smiles
[O-][N+](=O)OCl
Isomeric Smiles
ClO[N+](=O)[O-]
Calculated Properties
JChem
H Acceptors
3
H Donor
0
LogD (pH = 5.5)
0.944913
LogD (pH = 7.4)
0.944913
Log P
0.944913
Molar Refractivity
15.3949
Polarizability
5.76121
Polar Surface Area
55.05
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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