sodium;molecular hydrogen;sulfanide

H3NaS — CID 173253022

IUPACsodium;molecular hydrogen;sulfanide
SMILES[H][H].[Na+].[SH-]
InChIInChI=1S/Na.H2S.H2/h;1H2;1H/q+1;;/p-1
InChIKeyLBOSPSAKKAUAQG-UHFFFAOYSA-M
MW58.08 g/mol
LogP-3.02
Rot. Bonds

About sodium;molecular hydrogen;sulfanide

sodium;molecular hydrogen;sulfanide (PubChem CID 173253022) has the molecular formula H3NaS and a molecular weight of 58.08 g/mol. Its IUPAC name is sodium;molecular hydrogen;sulfanide.

Molecular Properties

Compound Namesodium;molecular hydrogen;sulfanide
PubChem CID173253022
Molecular FormulaH3NaS
Molecular Weight58.08 g/mol
Exact Mass57.99
IUPAC Namesodium;molecular hydrogen;sulfanide
SMILES[H][H].[Na+].[SH-]
InChIInChI=1S/Na.H2S.H2/h;1H2;1H/q+1;;/p-1
InChIKeyLBOSPSAKKAUAQG-UHFFFAOYSA-M
XLogP-3.02
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms2
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50058.08
LogP ≤ 5-3.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'thiol_1', 'substructure': 'N/A'}, {'alert_name': 'thiol_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of sodium;molecular hydrogen;sulfanide?
The IUPAC name of sodium;molecular hydrogen;sulfanide (CID 173253022) is sodium;molecular hydrogen;sulfanide.
What is the SMILES notation for sodium;molecular hydrogen;sulfanide?
The canonical SMILES for sodium;molecular hydrogen;sulfanide is [H][H].[Na+].[SH-].
What is the InChIKey of sodium;molecular hydrogen;sulfanide?
The InChIKey is LBOSPSAKKAUAQG-UHFFFAOYSA-M. The full InChI is InChI=1S/Na.H2S.H2/h;1H2;1H/q+1;;/p-1.
What are the key properties of sodium;molecular hydrogen;sulfanide?
sodium;molecular hydrogen;sulfanide has a molecular weight of 58.08 g/mol, XLogP of -3.02, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for sodium;molecular hydrogen;sulfanide is sourced from PubChem (CID 173253022), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).