sodium;disulfanylethane;hydride

C2H7NaS2 — CID 174860654

IUPACsodium;disulfanylethane;hydride
SMILESCCSS.[H-].[Na+]
InChIInChI=1S/C2H6S2.Na.H/c1-2-4-3;;/h3H,2H2,1H3;;/q;+1;-1
InChIKeyXDRWUZQVRUMMJY-UHFFFAOYSA-N
MW118.20 g/mol
LogP-1.30
Rot. Bonds1

About sodium;disulfanylethane;hydride

sodium;disulfanylethane;hydride (PubChem CID 174860654) has the molecular formula C2H7NaS2 and a molecular weight of 118.20 g/mol. Its IUPAC name is sodium;disulfanylethane;hydride.

Molecular Properties

Compound Namesodium;disulfanylethane;hydride
PubChem CID174860654
Molecular FormulaC2H7NaS2
Molecular Weight118.20 g/mol
Exact Mass117.99
IUPAC Namesodium;disulfanylethane;hydride
SMILESCCSS.[H-].[Na+]
InChIInChI=1S/C2H6S2.Na.H/c1-2-4-3;;/h3H,2H2,1H3;;/q;+1;-1
InChIKeyXDRWUZQVRUMMJY-UHFFFAOYSA-N
XLogP-1.30
TPSA0.00 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500118.20
LogP ≤ 5-1.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

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sodium propane
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sodium;ethylsilane;hydride
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1-(disulfanyl)octane
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Frequently Asked Questions

What is the IUPAC name of sodium;disulfanylethane;hydride?
The IUPAC name of sodium;disulfanylethane;hydride (CID 174860654) is sodium;disulfanylethane;hydride.
What is the SMILES notation for sodium;disulfanylethane;hydride?
The canonical SMILES for sodium;disulfanylethane;hydride is CCSS.[H-].[Na+].
What is the InChIKey of sodium;disulfanylethane;hydride?
The InChIKey is XDRWUZQVRUMMJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H6S2.Na.H/c1-2-4-3;;/h3H,2H2,1H3;;/q;+1;-1.
What are the key properties of sodium;disulfanylethane;hydride?
sodium;disulfanylethane;hydride has a molecular weight of 118.20 g/mol, XLogP of -1.30, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for sodium;disulfanylethane;hydride is sourced from PubChem (CID 174860654), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).