sodium;hydride;trimethylsilyl propane-1-sulfonate

C6H17NaO3SSi — CID 173422421

IUPACsodium;hydride;trimethylsilyl propane-1-sulfonate
SMILESCCCS(=O)(=O)O[Si](C)(C)C.[H-].[Na+]
InChIInChI=1S/C6H16O3SSi.Na.H/c1-5-6-10(7,8)9-11(2,3)4;;/h5-6H2,1-4H3;;/q;+1;-1
InChIKeyUDECKTKMWJNVHQ-UHFFFAOYSA-N
MW220.34 g/mol
LogP-1.31
Rot. Bonds4

About sodium;hydride;trimethylsilyl propane-1-sulfonate

sodium;hydride;trimethylsilyl propane-1-sulfonate (PubChem CID 173422421) has the molecular formula C6H17NaO3SSi and a molecular weight of 220.34 g/mol. Its IUPAC name is sodium;hydride;trimethylsilyl propane-1-sulfonate.

Molecular Properties

Compound Namesodium;hydride;trimethylsilyl propane-1-sulfonate
PubChem CID173422421
Molecular FormulaC6H17NaO3SSi
Molecular Weight220.34 g/mol
Exact Mass220.06
IUPAC Namesodium;hydride;trimethylsilyl propane-1-sulfonate
SMILESCCCS(=O)(=O)O[Si](C)(C)C.[H-].[Na+]
InChIInChI=1S/C6H16O3SSi.Na.H/c1-5-6-10(7,8)9-11(2,3)4;;/h5-6H2,1-4H3;;/q;+1;-1
InChIKeyUDECKTKMWJNVHQ-UHFFFAOYSA-N
XLogP-1.31
TPSA43.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.34
LogP ≤ 5-1.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-trimethylsilyloxysulfonylethanesulfonic acid
CID 87764518
tri(propan-2-yl)silyl propane-1-sulfonate
CID 21103012
trimethylsilyl 3-bromopropane-1-sulfonate
CID 554689
propylsulfonyl propane-1-sulfonate
CID 11031687
[ethyl(dimethyl)silyl] butane-1-sulfonate
CID 91419069
sodium;hydride;prop-2-ynyl propane-1-sulfonate
CID 175482201
hydroxy-oxo-propylsulfonyloxyphosphanium
CID 174575206
CID 175973653
CID 175973653
propylsulfonyl formate
CID 87151772
sodium;hydride;phenyl propane-1-sulfonate
CID 174291671
[dimethyl(octyl)silyl] butane-1-sulfonate
CID 90964254
sodium;hydride;methylcarbamothioyl propane-1-sulfonate
CID 174987122

Frequently Asked Questions

What is the IUPAC name of sodium;hydride;trimethylsilyl propane-1-sulfonate?
The IUPAC name of sodium;hydride;trimethylsilyl propane-1-sulfonate (CID 173422421) is sodium;hydride;trimethylsilyl propane-1-sulfonate.
What is the SMILES notation for sodium;hydride;trimethylsilyl propane-1-sulfonate?
The canonical SMILES for sodium;hydride;trimethylsilyl propane-1-sulfonate is CCCS(=O)(=O)O[Si](C)(C)C.[H-].[Na+].
What is the InChIKey of sodium;hydride;trimethylsilyl propane-1-sulfonate?
The InChIKey is UDECKTKMWJNVHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H16O3SSi.Na.H/c1-5-6-10(7,8)9-11(2,3)4;;/h5-6H2,1-4H3;;/q;+1;-1.
What are the key properties of sodium;hydride;trimethylsilyl propane-1-sulfonate?
sodium;hydride;trimethylsilyl propane-1-sulfonate has a molecular weight of 220.34 g/mol, XLogP of -1.31, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for sodium;hydride;trimethylsilyl propane-1-sulfonate is sourced from PubChem (CID 173422421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).