sodium;sulfanide;tetramethylazanium;hydroxide

C4H14NNaOS — CID 173362953

IUPACsodium;sulfanide;tetramethylazanium;hydroxide
SMILESC[N+](C)(C)C.[Na+].[OH-].[SH-]
InChIInChI=1S/C4H12N.Na.H2O.H2S/c1-5(2,3)4;;;/h1-4H3;;2*1H2/q2*+1;;/p-2
InChIKeyPTCLHTMDICXFJS-UHFFFAOYSA-L
MW147.22 g/mol
LogP-3.12
Rot. Bonds

About sodium;sulfanide;tetramethylazanium;hydroxide

sodium;sulfanide;tetramethylazanium;hydroxide (PubChem CID 173362953) has the molecular formula C4H14NNaOS and a molecular weight of 147.22 g/mol. Its IUPAC name is sodium;sulfanide;tetramethylazanium;hydroxide.

Molecular Properties

Compound Namesodium;sulfanide;tetramethylazanium;hydroxide
PubChem CID173362953
Molecular FormulaC4H14NNaOS
Molecular Weight147.22 g/mol
Exact Mass147.07
IUPAC Namesodium;sulfanide;tetramethylazanium;hydroxide
SMILESC[N+](C)(C)C.[Na+].[OH-].[SH-]
InChIInChI=1S/C4H12N.Na.H2O.H2S/c1-5(2,3)4;;;/h1-4H3;;2*1H2/q2*+1;;/p-2
InChIKeyPTCLHTMDICXFJS-UHFFFAOYSA-L
XLogP-3.12
TPSA30.00 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.22
LogP ≤ 5-3.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'quaternary_nitrogen_2', 'substructure': 'N/A'}, {'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;sulfanide;tetramethylazanium;hydroxide?
The IUPAC name of sodium;sulfanide;tetramethylazanium;hydroxide (CID 173362953) is sodium;sulfanide;tetramethylazanium;hydroxide.
What is the SMILES notation for sodium;sulfanide;tetramethylazanium;hydroxide?
The canonical SMILES for sodium;sulfanide;tetramethylazanium;hydroxide is C[N+](C)(C)C.[Na+].[OH-].[SH-].
What is the InChIKey of sodium;sulfanide;tetramethylazanium;hydroxide?
The InChIKey is PTCLHTMDICXFJS-UHFFFAOYSA-L. The full InChI is InChI=1S/C4H12N.Na.H2O.H2S/c1-5(2,3)4;;;/h1-4H3;;2*1H2/q2*+1;;/p-2.
What are the key properties of sodium;sulfanide;tetramethylazanium;hydroxide?
sodium;sulfanide;tetramethylazanium;hydroxide has a molecular weight of 147.22 g/mol, XLogP of -3.12, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for sodium;sulfanide;tetramethylazanium;hydroxide is sourced from PubChem (CID 173362953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).