phenyl-dipropyl-sulfanylidene-λ5-phosphane

C12H19PS — CID 135075774

IUPACphenyl-dipropyl-sulfanylidene-λ5-phosphane
SMILESCCCP(=S)(CCC)c1ccccc1
InChIInChI=1S/C12H19PS/c1-3-10-13(14,11-4-2)12-8-6-5-7-9-12/h5-9H,3-4,10-11H2,1-2H3
InChIKeyLKNWWCNAKQMESB-UHFFFAOYSA-N
MW226.33 g/mol
LogP3.61
Rot. Bonds5

About phenyl-dipropyl-sulfanylidene-λ5-phosphane

phenyl-dipropyl-sulfanylidene-λ5-phosphane (PubChem CID 135075774) has the molecular formula C12H19PS and a molecular weight of 226.33 g/mol. Its IUPAC name is phenyl-dipropyl-sulfanylidene-λ5-phosphane.

Molecular Properties

Compound Namephenyl-dipropyl-sulfanylidene-λ5-phosphane
PubChem CID135075774
Molecular FormulaC12H19PS
Molecular Weight226.33 g/mol
Exact Mass226.09
IUPAC Namephenyl-dipropyl-sulfanylidene-λ5-phosphane
SMILESCCCP(=S)(CCC)c1ccccc1
InChIInChI=1S/C12H19PS/c1-3-10-13(14,11-4-2)12-8-6-5-7-9-12/h5-9H,3-4,10-11H2,1-2H3
InChIKeyLKNWWCNAKQMESB-UHFFFAOYSA-N
XLogP3.61
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.33
LogP ≤ 53.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze phenyl-dipropyl-sulfanylidene-λ5-phosphane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

dioctyl-phenyl-sulfanylidene-λ5-phosphane
CID 54529232
bis(chloromethyl)-phenyl-sulfanylidene-λ5-phosphane
CID 23415957
tris(ethyl-phenyl-sulfanylidene-sulfido-λ5-phosphane);zirconium(3+)
CID 174385466
4-diethylphosphinothioylbutyl-diphenyl-sulfanylidene-lambda5-phosphane
CID 13159128
dibutoxy-phenyl-sulfanylidene-lambda5-phosphane
CID 10968132
[(Z)-oct-1-enyl]-diphenyl-sulfanylidene-λ5-phosphane
CID 122379298
[(Z)-1-diphenylphosphinothioylpent-1-en-2-yl]-diphenyl-sulfanylidene-λ5-phosphane
CID 102184006
[(E)-oct-1-enyl]-diphenyl-sulfanylidene-λ5-phosphane
CID 154722495
dimethyl-phenyl-sulfanylidene-λ5-phosphane;ethane
CID 91466135
2-[phenyl(propyl)phosphoryl]acetic acid
CID 11903752
diphenyl-sulfanylidene-[(Z)-2-trimethylsilylethenyl]-λ5-phosphane
CID 122379303
[ethyl(fluoro)phosphoryl]benzene
CID 23415746

Frequently Asked Questions

What is the IUPAC name of phenyl-dipropyl-sulfanylidene-λ5-phosphane?
The IUPAC name of phenyl-dipropyl-sulfanylidene-λ5-phosphane (CID 135075774) is phenyl-dipropyl-sulfanylidene-λ5-phosphane.
What is the SMILES notation for phenyl-dipropyl-sulfanylidene-λ5-phosphane?
The canonical SMILES for phenyl-dipropyl-sulfanylidene-λ5-phosphane is CCCP(=S)(CCC)c1ccccc1.
What is the InChIKey of phenyl-dipropyl-sulfanylidene-λ5-phosphane?
The InChIKey is LKNWWCNAKQMESB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19PS/c1-3-10-13(14,11-4-2)12-8-6-5-7-9-12/h5-9H,3-4,10-11H2,1-2H3.
What are the key properties of phenyl-dipropyl-sulfanylidene-λ5-phosphane?
phenyl-dipropyl-sulfanylidene-λ5-phosphane has a molecular weight of 226.33 g/mol, XLogP of 3.61, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for phenyl-dipropyl-sulfanylidene-λ5-phosphane is sourced from PubChem (CID 135075774), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).