furan-2-yl-diphenyl-selanylidene-λ5-phosphane

C16H13OPSe — CID 23417414

IUPACfuran-2-yl-diphenyl-selanylidene-λ5-phosphane
SMILES[Se]=P(c1ccccc1)(c1ccccc1)c1ccco1
InChIInChI=1S/C16H13OPSe/c19-18(16-12-7-13-17-16,14-8-3-1-4-9-14)15-10-5-2-6-11-15/h1-13H
InChIKeyQZLITPOZISRBBX-UHFFFAOYSA-N
MW331.21 g/mol
LogP2.66
Rot. Bonds3

About furan-2-yl-diphenyl-selanylidene-λ5-phosphane

furan-2-yl-diphenyl-selanylidene-λ5-phosphane (PubChem CID 23417414) has the molecular formula C16H13OPSe and a molecular weight of 331.21 g/mol. Its IUPAC name is furan-2-yl-diphenyl-selanylidene-λ5-phosphane.

Molecular Properties

Compound Namefuran-2-yl-diphenyl-selanylidene-λ5-phosphane
PubChem CID23417414
Molecular FormulaC16H13OPSe
Molecular Weight331.21 g/mol
Exact Mass331.99
IUPAC Namefuran-2-yl-diphenyl-selanylidene-λ5-phosphane
SMILES[Se]=P(c1ccccc1)(c1ccccc1)c1ccco1
InChIInChI=1S/C16H13OPSe/c19-18(16-12-7-13-17-16,14-8-3-1-4-9-14)15-10-5-2-6-11-15/h1-13H
InChIKeyQZLITPOZISRBBX-UHFFFAOYSA-N
XLogP2.66
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.21
LogP ≤ 52.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of furan-2-yl-diphenyl-selanylidene-λ5-phosphane?
The IUPAC name of furan-2-yl-diphenyl-selanylidene-λ5-phosphane (CID 23417414) is furan-2-yl-diphenyl-selanylidene-λ5-phosphane.
What is the SMILES notation for furan-2-yl-diphenyl-selanylidene-λ5-phosphane?
The canonical SMILES for furan-2-yl-diphenyl-selanylidene-λ5-phosphane is [Se]=P(c1ccccc1)(c1ccccc1)c1ccco1.
What is the InChIKey of furan-2-yl-diphenyl-selanylidene-λ5-phosphane?
The InChIKey is QZLITPOZISRBBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13OPSe/c19-18(16-12-7-13-17-16,14-8-3-1-4-9-14)15-10-5-2-6-11-15/h1-13H.
What are the key properties of furan-2-yl-diphenyl-selanylidene-λ5-phosphane?
furan-2-yl-diphenyl-selanylidene-λ5-phosphane has a molecular weight of 331.21 g/mol, XLogP of 2.66, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for furan-2-yl-diphenyl-selanylidene-λ5-phosphane is sourced from PubChem (CID 23417414), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).