sodium nitrite

NNaO2 — CID 23668193

IUPACsodium nitrite
SMILESO=N[O-].[Na+]
InChIInChI=1S/HNO2.Na/c2-1-3;/h(H,2,3);/q;+1/p-1
InChIKeyLPXPTNMVRIOKMN-UHFFFAOYSA-M
MW69.00 g/mol
LogP-2.75
Rot. Bonds

About sodium nitrite

sodium nitrite (PubChem CID 23668193) has the molecular formula NNaO2 and a molecular weight of 69.00 g/mol. Its IUPAC name is sodium nitrite.

Molecular Properties

Compound Namesodium nitrite
PubChem CID23668193
Molecular FormulaNNaO2
Molecular Weight69.00 g/mol
Exact Mass68.98
IUPAC Namesodium nitrite
SMILESO=N[O-].[Na+]
InChIInChI=1S/HNO2.Na/c2-1-3;/h(H,2,3);/q;+1/p-1
InChIKeyLPXPTNMVRIOKMN-UHFFFAOYSA-M
XLogP-2.75
TPSA52.49 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms4
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50069.00
LogP ≤ 5-2.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

Sodium Nitrate
CID 24268
Nitrate
CID 943
Nitrite
CID 946
Nitrogen Dioxide
CID 3032552
Hydron nitrite
CID 173080259
Nitronium
CID 3609161
Radium nitrate
CID 56844152
Sodium nitrite N-15
CID 23662135
Nitrate radical
CID 5360456
Sodium nitrate N-15
CID 11446290
Sodium;oxido nitrite
CID 23677810
sodium;dioxido(oxo)(15N)ammonium
CID 170853126

Frequently Asked Questions

What is the IUPAC name of sodium nitrite?
The IUPAC name of sodium nitrite (CID 23668193) is sodium nitrite.
What is the SMILES notation for sodium nitrite?
The canonical SMILES for sodium nitrite is O=N[O-].[Na+].
What is the InChIKey of sodium nitrite?
The InChIKey is LPXPTNMVRIOKMN-UHFFFAOYSA-M. The full InChI is InChI=1S/HNO2.Na/c2-1-3;/h(H,2,3);/q;+1/p-1.
What are the key properties of sodium nitrite?
sodium nitrite has a molecular weight of 69.00 g/mol, XLogP of -2.75, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for sodium nitrite is sourced from PubChem (CID 23668193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).