nitric acid;nitrous acid;hydrochloride

H3ClN2O5 — CID 173075414

IUPACnitric acid;nitrous acid;hydrochloride
SMILESCl.O=NO.O=[N+]([O-])O
InChIInChI=1S/ClH.HNO3.HNO2/c;2-1(3)4;2-1-3/h1H;(H,2,3,4);(H,2,3)
InChIKeyPLHCTQAFRCDNKO-UHFFFAOYSA-N
MW146.49 g/mol
LogP0.22
Rot. Bonds

About nitric acid;nitrous acid;hydrochloride

nitric acid;nitrous acid;hydrochloride (PubChem CID 173075414) has the molecular formula H3ClN2O5 and a molecular weight of 146.49 g/mol. Its IUPAC name is nitric acid;nitrous acid;hydrochloride.

Molecular Properties

Compound Namenitric acid;nitrous acid;hydrochloride
PubChem CID173075414
Molecular FormulaH3ClN2O5
Molecular Weight146.49 g/mol
Exact Mass145.97
IUPAC Namenitric acid;nitrous acid;hydrochloride
SMILESCl.O=NO.O=[N+]([O-])O
InChIInChI=1S/ClH.HNO3.HNO2/c;2-1(3)4;2-1-3/h1H;(H,2,3,4);(H,2,3)
InChIKeyPLHCTQAFRCDNKO-UHFFFAOYSA-N
XLogP0.22
TPSA113.03 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.49
LogP ≤ 50.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

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sodium;azane;nitric acid;nitrous acid;sulfuric acid;chloride
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iron(3+);nitric acid;trichloride;hydrochloride
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calcium;hydride;bis(nitric acid);hydrochloride
CID 173046786
sodium;azane;nitrous acid;sulfane;nitrate
CID 172727872
cobalt;bis(nitric acid)
CID 59294240
nickel;nitric acid
CID 157159085
nitric acid;dodecahydrate
CID 172786901
tris(nitric acid);hexahydrate
CID 161328835

Frequently Asked Questions

What is the IUPAC name of nitric acid;nitrous acid;hydrochloride?
The IUPAC name of nitric acid;nitrous acid;hydrochloride (CID 173075414) is nitric acid;nitrous acid;hydrochloride.
What is the SMILES notation for nitric acid;nitrous acid;hydrochloride?
The canonical SMILES for nitric acid;nitrous acid;hydrochloride is Cl.O=NO.O=[N+]([O-])O.
What is the InChIKey of nitric acid;nitrous acid;hydrochloride?
The InChIKey is PLHCTQAFRCDNKO-UHFFFAOYSA-N. The full InChI is InChI=1S/ClH.HNO3.HNO2/c;2-1(3)4;2-1-3/h1H;(H,2,3,4);(H,2,3).
What are the key properties of nitric acid;nitrous acid;hydrochloride?
nitric acid;nitrous acid;hydrochloride has a molecular weight of 146.49 g/mol, XLogP of 0.22, 0 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for nitric acid;nitrous acid;hydrochloride is sourced from PubChem (CID 173075414), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).