2,2-diphenylethyl-diphenyl-sulfanylidene-lambda5-phosphane

C26H23PS — CID 10739652

IUPAC2,2-diphenylethyl-diphenyl-sulfanylidene-lambda5-phosphane
SMILESS=P(CC(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C26H23PS/c28-27(24-17-9-3-10-18-24,25-19-11-4-12-20-25)21-26(22-13-5-1-6-14-22)23-15-7-2-8-16-23/h1-20,26H,21H2
InChIKeyIXVGPQFZCXOLGU-UHFFFAOYSA-N
MW398.51 g/mol
LogP5.95
Rot. Bonds6

About 2,2-diphenylethyl-diphenyl-sulfanylidene-lambda5-phosphane

2,2-diphenylethyl-diphenyl-sulfanylidene-lambda5-phosphane (PubChem CID 10739652) has the molecular formula C26H23PS and a molecular weight of 398.51 g/mol. Its IUPAC name is 2,2-diphenylethyl-diphenyl-sulfanylidene-lambda5-phosphane.

Molecular Properties

Compound Name2,2-diphenylethyl-diphenyl-sulfanylidene-lambda5-phosphane
PubChem CID10739652
Molecular FormulaC26H23PS
Molecular Weight398.51 g/mol
Exact Mass398.13
IUPAC Name2,2-diphenylethyl-diphenyl-sulfanylidene-lambda5-phosphane
SMILESS=P(CC(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C26H23PS/c28-27(24-17-9-3-10-18-24,25-19-11-4-12-20-25)21-26(22-13-5-1-6-14-22)23-15-7-2-8-16-23/h1-20,26H,21H2
InChIKeyIXVGPQFZCXOLGU-UHFFFAOYSA-N
XLogP5.95
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500398.51
LogP ≤ 55.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

benzhydryloxy-diphenyl-sulfanylidene-lambda5-phosphane
CID 12868443
2-diphenylphosphinothioylacetamide
CID 796912
(3-diphenylphosphinothioyl-1-phenylpropyl) benzoate
CID 25268290
[2-(2-chloro-4-pyridinyl)-2-ethoxyethyl]-diphenyl-sulfanylidene-λ5-phosphane
CID 162406997
bis(1,3-dichloropropan-2-yloxy)-phenyl-sulfanylidene-λ5-phosphane
CID 141440173
diphenyl-(1-phenylprop-2-enyl)-sulfanylidene-λ5-phosphane
CID 71416955
bis(chloromethyl)-phenyl-sulfanylidene-λ5-phosphane
CID 23415957
Diphenylselenothiophosphinic acid
CID 11243432
oxido-diphenyl-sulfanylidene-λ5-phosphane
CID 3382215
CID 140568629
CID 140568629
bromo-diphenyl-sulfanylidene-λ5-phosphane
CID 23415811
4-diethylphosphinothioylbutyl-diphenyl-sulfanylidene-lambda5-phosphane
CID 13159128

Frequently Asked Questions

What is the IUPAC name of 2,2-diphenylethyl-diphenyl-sulfanylidene-lambda5-phosphane?
The IUPAC name of 2,2-diphenylethyl-diphenyl-sulfanylidene-lambda5-phosphane (CID 10739652) is 2,2-diphenylethyl-diphenyl-sulfanylidene-lambda5-phosphane.
What is the SMILES notation for 2,2-diphenylethyl-diphenyl-sulfanylidene-lambda5-phosphane?
The canonical SMILES for 2,2-diphenylethyl-diphenyl-sulfanylidene-lambda5-phosphane is S=P(CC(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1.
What is the InChIKey of 2,2-diphenylethyl-diphenyl-sulfanylidene-lambda5-phosphane?
The InChIKey is IXVGPQFZCXOLGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H23PS/c28-27(24-17-9-3-10-18-24,25-19-11-4-12-20-25)21-26(22-13-5-1-6-14-22)23-15-7-2-8-16-23/h1-20,26H,21H2.
What are the key properties of 2,2-diphenylethyl-diphenyl-sulfanylidene-lambda5-phosphane?
2,2-diphenylethyl-diphenyl-sulfanylidene-lambda5-phosphane has a molecular weight of 398.51 g/mol, XLogP of 5.95, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-diphenylethyl-diphenyl-sulfanylidene-lambda5-phosphane is sourced from PubChem (CID 10739652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).