bis(2-phenylethyl)-selanylidene-selenido-λ5-phosphane

C16H18PSe2- — CID 46910600

IUPACbis(2-phenylethyl)-selanylidene-selenido-λ5-phosphane
SMILES[Se]=P([Se-])(CCc1ccccc1)CCc1ccccc1
InChIInChI=1S/C16H19PSe2/c18-17(19,13-11-15-7-3-1-4-8-15)14-12-16-9-5-2-6-10-16/h1-10H,11-14H2,(H,18,19)/p-1
InChIKeyUHMHOHSXKOPNPO-UHFFFAOYSA-M
MW399.21 g/mol
LogP3.66
Rot. Bonds6

About bis(2-phenylethyl)-selanylidene-selenido-λ5-phosphane

bis(2-phenylethyl)-selanylidene-selenido-λ5-phosphane (PubChem CID 46910600) has the molecular formula C16H18PSe2- and a molecular weight of 399.21 g/mol. Its IUPAC name is bis(2-phenylethyl)-selanylidene-selenido-λ5-phosphane.

Molecular Properties

Compound Namebis(2-phenylethyl)-selanylidene-selenido-λ5-phosphane
PubChem CID46910600
Molecular FormulaC16H18PSe2-
Molecular Weight399.21 g/mol
Exact Mass400.95
IUPAC Namebis(2-phenylethyl)-selanylidene-selenido-λ5-phosphane
SMILES[Se]=P([Se-])(CCc1ccccc1)CCc1ccccc1
InChIInChI=1S/C16H19PSe2/c18-17(19,13-11-15-7-3-1-4-8-15)14-12-16-9-5-2-6-10-16/h1-10H,11-14H2,(H,18,19)/p-1
InChIKeyUHMHOHSXKOPNPO-UHFFFAOYSA-M
XLogP3.66
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500399.21
LogP ≤ 53.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

diphenyl-(2-phenylethyl)-selanylidene-λ5-phosphane
CID 132605440
benzene;2-phenylethylbenzene
CID 18982764
2-dichlorophosphorylethylbenzene
CID 15169214
hafnium;2-phenylethylbenzene
CID 173109801
2-phenylethylbenzene;phosphono dihydrogen phosphate
CID 174463104
bis(2-phenylethyl)phosphinothioylselanyl-bis(2-phenylethyl)-sulfanylidene-λ5-phosphane
CID 102190116
alumane;2-phenylethylbenzene;hydrobromide
CID 173446278
4-phenylbutylbenzene
CID 141301927
[hydroxy(2-phenylethyl)phosphoryl]formic acid
CID 69405500
[chlorooxy(2-phenylethyl)phosphoryl] hypochlorite
CID 162515513
hafnium;4-phenylbutylbenzene
CID 175889972
1,4-bis(3-phenylpropyl)benzene
CID 59467322

Frequently Asked Questions

What is the IUPAC name of bis(2-phenylethyl)-selanylidene-selenido-λ5-phosphane?
The IUPAC name of bis(2-phenylethyl)-selanylidene-selenido-λ5-phosphane (CID 46910600) is bis(2-phenylethyl)-selanylidene-selenido-λ5-phosphane.
What is the SMILES notation for bis(2-phenylethyl)-selanylidene-selenido-λ5-phosphane?
The canonical SMILES for bis(2-phenylethyl)-selanylidene-selenido-λ5-phosphane is [Se]=P([Se-])(CCc1ccccc1)CCc1ccccc1.
What is the InChIKey of bis(2-phenylethyl)-selanylidene-selenido-λ5-phosphane?
The InChIKey is UHMHOHSXKOPNPO-UHFFFAOYSA-M. The full InChI is InChI=1S/C16H19PSe2/c18-17(19,13-11-15-7-3-1-4-8-15)14-12-16-9-5-2-6-10-16/h1-10H,11-14H2,(H,18,19)/p-1.
What are the key properties of bis(2-phenylethyl)-selanylidene-selenido-λ5-phosphane?
bis(2-phenylethyl)-selanylidene-selenido-λ5-phosphane has a molecular weight of 399.21 g/mol, XLogP of 3.66, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for bis(2-phenylethyl)-selanylidene-selenido-λ5-phosphane is sourced from PubChem (CID 46910600), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).