sulfanylidene-tris(trimethylsilyloxy)-lambda5-phosphane

C9H27O3PSSi3 — CID 12507881

IUPACsulfanylidene-tris(trimethylsilyloxy)-lambda5-phosphane
SMILESC[Si](C)(C)OP(=S)(O[Si](C)(C)C)O[Si](C)(C)C
InChIInChI=1S/C9H27O3PSSi3/c1-15(2,3)10-13(14,11-16(4,5)6)12-17(7,8)9/h1-9H3
InChIKeySXMXKQXIKVZFBH-UHFFFAOYSA-N
MW330.61 g/mol
LogP4.77
Rot. Bonds6

About sulfanylidene-tris(trimethylsilyloxy)-lambda5-phosphane

sulfanylidene-tris(trimethylsilyloxy)-lambda5-phosphane (PubChem CID 12507881) has the molecular formula C9H27O3PSSi3 and a molecular weight of 330.61 g/mol. Its IUPAC name is sulfanylidene-tris(trimethylsilyloxy)-lambda5-phosphane.

Molecular Properties

Compound Namesulfanylidene-tris(trimethylsilyloxy)-lambda5-phosphane
PubChem CID12507881
Molecular FormulaC9H27O3PSSi3
Molecular Weight330.61 g/mol
Exact Mass330.07
IUPAC Namesulfanylidene-tris(trimethylsilyloxy)-lambda5-phosphane
SMILESC[Si](C)(C)OP(=S)(O[Si](C)(C)C)O[Si](C)(C)C
InChIInChI=1S/C9H27O3PSSi3/c1-15(2,3)10-13(14,11-16(4,5)6)12-17(7,8)9/h1-9H3
InChIKeySXMXKQXIKVZFBH-UHFFFAOYSA-N
XLogP4.77
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.61
LogP ≤ 54.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of sulfanylidene-tris(trimethylsilyloxy)-lambda5-phosphane?
The IUPAC name of sulfanylidene-tris(trimethylsilyloxy)-lambda5-phosphane (CID 12507881) is sulfanylidene-tris(trimethylsilyloxy)-lambda5-phosphane.
What is the SMILES notation for sulfanylidene-tris(trimethylsilyloxy)-lambda5-phosphane?
The canonical SMILES for sulfanylidene-tris(trimethylsilyloxy)-lambda5-phosphane is C[Si](C)(C)OP(=S)(O[Si](C)(C)C)O[Si](C)(C)C.
What is the InChIKey of sulfanylidene-tris(trimethylsilyloxy)-lambda5-phosphane?
The InChIKey is SXMXKQXIKVZFBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H27O3PSSi3/c1-15(2,3)10-13(14,11-16(4,5)6)12-17(7,8)9/h1-9H3.
What are the key properties of sulfanylidene-tris(trimethylsilyloxy)-lambda5-phosphane?
sulfanylidene-tris(trimethylsilyloxy)-lambda5-phosphane has a molecular weight of 330.61 g/mol, XLogP of 4.77, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for sulfanylidene-tris(trimethylsilyloxy)-lambda5-phosphane is sourced from PubChem (CID 12507881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).