phenyl-(1-phenylethenyl)-propan-2-yl-sulfanylidene-λ5-phosphane

C17H19PS — CID 164669301

IUPACphenyl-(1-phenylethenyl)-propan-2-yl-sulfanylidene-λ5-phosphane
SMILESC=C(c1ccccc1)[P@@](=S)(c1ccccc1)C(C)C
InChIInChI=1S/C17H19PS/c1-14(2)18(19,17-12-8-5-9-13-17)15(3)16-10-6-4-7-11-16/h4-14H,3H2,1-2H3/t18-/m1/s1
InChIKeyNTAULDSNPJREQR-GOSISDBHSA-N
MW286.38 g/mol
LogP4.87
Rot. Bonds4

About phenyl-(1-phenylethenyl)-propan-2-yl-sulfanylidene-λ5-phosphane

phenyl-(1-phenylethenyl)-propan-2-yl-sulfanylidene-λ5-phosphane (PubChem CID 164669301) has the molecular formula C17H19PS and a molecular weight of 286.38 g/mol. Its IUPAC name is phenyl-(1-phenylethenyl)-propan-2-yl-sulfanylidene-λ5-phosphane.

Molecular Properties

Compound Namephenyl-(1-phenylethenyl)-propan-2-yl-sulfanylidene-λ5-phosphane
PubChem CID164669301
Molecular FormulaC17H19PS
Molecular Weight286.38 g/mol
Exact Mass286.09
IUPAC Namephenyl-(1-phenylethenyl)-propan-2-yl-sulfanylidene-λ5-phosphane
SMILESC=C(c1ccccc1)[P@@](=S)(c1ccccc1)C(C)C
InChIInChI=1S/C17H19PS/c1-14(2)18(19,17-12-8-5-9-13-17)15(3)16-10-6-4-7-11-16/h4-14H,3H2,1-2H3/t18-/m1/s1
InChIKeyNTAULDSNPJREQR-GOSISDBHSA-N
XLogP4.87
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.38
LogP ≤ 54.87
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

1-dimethylphosphorylethenylbenzene
CID 89402997
dimethyl-phenyl-sulfanylidene-λ5-phosphane;ethane
CID 91466135
methyl-phenyl-sulfanyl-sulfanylidene-lambda5-phosphane
CID 586594
N-[dimethylamino(1-phenylethenyl)phosphoryl]-N-methylmethanamine
CID 71427934
but-3-en-2-yloxy(1-phenylethenyl)phosphinic acid
CID 88759865
oxido-diphenyl-sulfanylidene-λ5-phosphane
CID 3382215
1-phenylethenyl-tri(propan-2-yl)silane
CID 102241725
diphenylphosphinothioyl(phenyl)methanone
CID 54293875
4-methylpent-1-en-3-yloxy(1-phenylethenyl)phosphinic acid
CID 88760741
CID 50986602
CID 50986602
(E)-1,2-diphenylethene-1,2-dithiolate
CID 102075609
1-methoxy-3-[1-phenylpropa-1,2-dienyl(propan-2-yl)phosphoryl]benzene
CID 164513905

Frequently Asked Questions

What is the IUPAC name of phenyl-(1-phenylethenyl)-propan-2-yl-sulfanylidene-λ5-phosphane?
The IUPAC name of phenyl-(1-phenylethenyl)-propan-2-yl-sulfanylidene-λ5-phosphane (CID 164669301) is phenyl-(1-phenylethenyl)-propan-2-yl-sulfanylidene-λ5-phosphane.
What is the SMILES notation for phenyl-(1-phenylethenyl)-propan-2-yl-sulfanylidene-λ5-phosphane?
The canonical SMILES for phenyl-(1-phenylethenyl)-propan-2-yl-sulfanylidene-λ5-phosphane is C=C(c1ccccc1)[P@@](=S)(c1ccccc1)C(C)C.
What is the InChIKey of phenyl-(1-phenylethenyl)-propan-2-yl-sulfanylidene-λ5-phosphane?
The InChIKey is NTAULDSNPJREQR-GOSISDBHSA-N. The full InChI is InChI=1S/C17H19PS/c1-14(2)18(19,17-12-8-5-9-13-17)15(3)16-10-6-4-7-11-16/h4-14H,3H2,1-2H3/t18-/m1/s1.
What are the key properties of phenyl-(1-phenylethenyl)-propan-2-yl-sulfanylidene-λ5-phosphane?
phenyl-(1-phenylethenyl)-propan-2-yl-sulfanylidene-λ5-phosphane has a molecular weight of 286.38 g/mol, XLogP of 4.87, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for phenyl-(1-phenylethenyl)-propan-2-yl-sulfanylidene-λ5-phosphane is sourced from PubChem (CID 164669301), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).