phenoxy-phenyl-silyl-sulfanylidene-λ5-phosphane

C12H13OPSSi — CID 174962173

IUPACphenoxy-phenyl-silyl-sulfanylidene-λ5-phosphane
SMILES[SiH3]P(=S)(Oc1ccccc1)c1ccccc1
InChIInChI=1S/C12H13OPSSi/c15-14(16,12-9-5-2-6-10-12)13-11-7-3-1-4-8-11/h1-10H,16H3
InChIKeyKLXQRBLYTZAHOM-UHFFFAOYSA-N
MW264.36 g/mol
LogP2.07
Rot. Bonds3

About phenoxy-phenyl-silyl-sulfanylidene-λ5-phosphane

phenoxy-phenyl-silyl-sulfanylidene-λ5-phosphane (PubChem CID 174962173) has the molecular formula C12H13OPSSi and a molecular weight of 264.36 g/mol. Its IUPAC name is phenoxy-phenyl-silyl-sulfanylidene-λ5-phosphane.

Molecular Properties

Compound Namephenoxy-phenyl-silyl-sulfanylidene-λ5-phosphane
PubChem CID174962173
Molecular FormulaC12H13OPSSi
Molecular Weight264.36 g/mol
Exact Mass264.02
IUPAC Namephenoxy-phenyl-silyl-sulfanylidene-λ5-phosphane
SMILES[SiH3]P(=S)(Oc1ccccc1)c1ccccc1
InChIInChI=1S/C12H13OPSSi/c15-14(16,12-9-5-2-6-10-12)13-11-7-3-1-4-8-11/h1-10H,16H3
InChIKeyKLXQRBLYTZAHOM-UHFFFAOYSA-N
XLogP2.07
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.36
LogP ≤ 52.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

phenoxy-diphenyl-sulfanylidene-lambda5-phosphane
CID 13410918
zinc oxido-diphenoxy-sulfanylidene-lambda5-phosphane
CID 18762383
diphenoxy-sulfanylidene-sulfido-λ5-phosphane
CID 3553797
diphenoxyphosphorylsilane;phosphane
CID 174958468
sodium phenoxy(phenyl)phosphinate
CID 161254659
dihydroxy-phenoxy-sulfanylidene-λ5-phosphane;ethene
CID 88776379
diphenoxyphosphinothioylcyanamide
CID 134907897
(3-diphenylphosphinothioyloxyphenyl)-diphenyl-sulfanylidene-λ5-phosphane
CID 102296827
dihydroxy-[hydroxy(phenoxy)phosphinothioyl]oxy-sulfanylidene-λ5-phosphane
CID 87475598
chloro-(chloromethyl)-phenoxy-sulfanylidene-lambda5-phosphane
CID 14812628
diphenoxy-sulfanyl-sulfanylidene-λ5-phosphane azide
CID 172686143
isocyanic acid;triphenoxy(sulfanylidene)-λ5-phosphane
CID 172773715

Frequently Asked Questions

What is the IUPAC name of phenoxy-phenyl-silyl-sulfanylidene-λ5-phosphane?
The IUPAC name of phenoxy-phenyl-silyl-sulfanylidene-λ5-phosphane (CID 174962173) is phenoxy-phenyl-silyl-sulfanylidene-λ5-phosphane.
What is the SMILES notation for phenoxy-phenyl-silyl-sulfanylidene-λ5-phosphane?
The canonical SMILES for phenoxy-phenyl-silyl-sulfanylidene-λ5-phosphane is [SiH3]P(=S)(Oc1ccccc1)c1ccccc1.
What is the InChIKey of phenoxy-phenyl-silyl-sulfanylidene-λ5-phosphane?
The InChIKey is KLXQRBLYTZAHOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13OPSSi/c15-14(16,12-9-5-2-6-10-12)13-11-7-3-1-4-8-11/h1-10H,16H3.
What are the key properties of phenoxy-phenyl-silyl-sulfanylidene-λ5-phosphane?
phenoxy-phenyl-silyl-sulfanylidene-λ5-phosphane has a molecular weight of 264.36 g/mol, XLogP of 2.07, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for phenoxy-phenyl-silyl-sulfanylidene-λ5-phosphane is sourced from PubChem (CID 174962173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).