sodium;azane;hydrogen sulfite

H7N2NaO3S — CID 173222991

IUPACsodium;azane;hydrogen sulfite
SMILESN.N.O=S([O-])O.[Na+]
InChIInChI=1S/2H3N.Na.H2O3S/c;;;1-4(2)3/h2*1H3;;(H2,1,2,3)/q;;+1;/p-1
InChIKeyGYZPPBAZDRGAKT-UHFFFAOYSA-M
MW138.12 g/mol
LogP-3.33
Rot. Bonds

About sodium;azane;hydrogen sulfite

sodium;azane;hydrogen sulfite (PubChem CID 173222991) has the molecular formula H7N2NaO3S and a molecular weight of 138.12 g/mol. Its IUPAC name is sodium;azane;hydrogen sulfite.

Molecular Properties

Compound Namesodium;azane;hydrogen sulfite
PubChem CID173222991
Molecular FormulaH7N2NaO3S
Molecular Weight138.12 g/mol
Exact Mass138.01
IUPAC Namesodium;azane;hydrogen sulfite
SMILESN.N.O=S([O-])O.[Na+]
InChIInChI=1S/2H3N.Na.H2O3S/c;;;1-4(2)3/h2*1H3;;(H2,1,2,3)/q;;+1;/p-1
InChIKeyGYZPPBAZDRGAKT-UHFFFAOYSA-M
XLogP-3.33
TPSA130.36 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.12
LogP ≤ 5-3.33
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'sulfinic_acid', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of sodium;azane;hydrogen sulfite?
The IUPAC name of sodium;azane;hydrogen sulfite (CID 173222991) is sodium;azane;hydrogen sulfite.
What is the SMILES notation for sodium;azane;hydrogen sulfite?
The canonical SMILES for sodium;azane;hydrogen sulfite is N.N.O=S([O-])O.[Na+].
What is the InChIKey of sodium;azane;hydrogen sulfite?
The InChIKey is GYZPPBAZDRGAKT-UHFFFAOYSA-M. The full InChI is InChI=1S/2H3N.Na.H2O3S/c;;;1-4(2)3/h2*1H3;;(H2,1,2,3)/q;;+1;/p-1.
What are the key properties of sodium;azane;hydrogen sulfite?
sodium;azane;hydrogen sulfite has a molecular weight of 138.12 g/mol, XLogP of -3.33, 0 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for sodium;azane;hydrogen sulfite is sourced from PubChem (CID 173222991), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).