iodo nitrate

INO3 — CID 13406959

IUPACiodo nitrate
SMILESO=[N+]([O-])OI
InChIInChI=1S/INO3/c1-5-2(3)4
InChIKeyCCJHDZZUWZIVJF-UHFFFAOYSA-N
MW188.91 g/mol
LogP0.54
Rot. Bonds1

About iodo nitrate

iodo nitrate (PubChem CID 13406959) has the molecular formula INO3 and a molecular weight of 188.91 g/mol. Its IUPAC name is iodo nitrate.

Molecular Properties

Compound Nameiodo nitrate
PubChem CID13406959
Molecular FormulaINO3
Molecular Weight188.91 g/mol
Exact Mass188.89
IUPAC Nameiodo nitrate
SMILESO=[N+]([O-])OI
InChIInChI=1S/INO3/c1-5-2(3)4
InChIKeyCCJHDZZUWZIVJF-UHFFFAOYSA-N
XLogP0.54
TPSA52.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.91
LogP ≤ 50.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'iodine', 'substructure': 'N/A'}, {'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

nitric acid;ruthenium;dinitrate
CID 173436166
methyl nitrate
CID 11724
bismuthane;nitro nitrate
CID 174723286
azane;hydroxy nitrate
CID 173145569
chloro nitrate
CID 174442535
zinc oxido nitrate
CID 173013987
hydroxy nitrate;lanthanum
CID 159833759
amino nitrate;mercury
CID 174849220
calcium methyl nitrate
CID 87508998
alumane;hydroxy nitrate;zinc
CID 173333197
amino nitrate;platinum
CID 174487148
chloro nitrate;stibane
CID 174852416

Frequently Asked Questions

What is the IUPAC name of iodo nitrate?
The IUPAC name of iodo nitrate (CID 13406959) is iodo nitrate.
What is the SMILES notation for iodo nitrate?
The canonical SMILES for iodo nitrate is O=[N+]([O-])OI.
What is the InChIKey of iodo nitrate?
The InChIKey is CCJHDZZUWZIVJF-UHFFFAOYSA-N. The full InChI is InChI=1S/INO3/c1-5-2(3)4.
What are the key properties of iodo nitrate?
iodo nitrate has a molecular weight of 188.91 g/mol, XLogP of 0.54, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for iodo nitrate is sourced from PubChem (CID 13406959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).