triphenyl(sulfanyl)silane

C18H16SSi — CID 621128

IUPACtriphenyl(sulfanyl)silane
SMILESS[Si](c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C18H16SSi/c19-20(16-10-4-1-5-11-16,17-12-6-2-7-13-17)18-14-8-3-9-15-18/h1-15,19H
InChIKeyMQDRKELSDPESDZ-UHFFFAOYSA-N
MW292.48 g/mol
LogP2.58
Rot. Bonds3

About triphenyl(sulfanyl)silane

triphenyl(sulfanyl)silane (PubChem CID 621128) has the molecular formula C18H16SSi and a molecular weight of 292.48 g/mol. Its IUPAC name is triphenyl(sulfanyl)silane.

Molecular Properties

Compound Nametriphenyl(sulfanyl)silane
PubChem CID621128
Molecular FormulaC18H16SSi
Molecular Weight292.48 g/mol
Exact Mass292.07
IUPAC Nametriphenyl(sulfanyl)silane
SMILESS[Si](c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C18H16SSi/c19-20(16-10-4-1-5-11-16,17-12-6-2-7-13-17)18-14-8-3-9-15-18/h1-15,19H
InChIKeyMQDRKELSDPESDZ-UHFFFAOYSA-N
XLogP2.58
TPSA0.00 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.48
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'thiol_2', 'substructure': 'N/A'}, {'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of triphenyl(sulfanyl)silane?
The IUPAC name of triphenyl(sulfanyl)silane (CID 621128) is triphenyl(sulfanyl)silane.
What is the SMILES notation for triphenyl(sulfanyl)silane?
The canonical SMILES for triphenyl(sulfanyl)silane is S[Si](c1ccccc1)(c1ccccc1)c1ccccc1.
What is the InChIKey of triphenyl(sulfanyl)silane?
The InChIKey is MQDRKELSDPESDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16SSi/c19-20(16-10-4-1-5-11-16,17-12-6-2-7-13-17)18-14-8-3-9-15-18/h1-15,19H.
What are the key properties of triphenyl(sulfanyl)silane?
triphenyl(sulfanyl)silane has a molecular weight of 292.48 g/mol, XLogP of 2.58, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for triphenyl(sulfanyl)silane is sourced from PubChem (CID 621128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).