hydroxy-phenyl-selanylidene-selenido-λ5-phosphane

C6H6OPSe2- — CID 139152128

IUPAChydroxy-phenyl-selanylidene-selenido-λ5-phosphane
SMILESO[P@@](=[Se])([Se-])c1ccccc1
InChIInChI=1S/C6H7OPSe2/c7-8(9,10)6-4-2-1-3-5-6/h1-5H,(H2,7,9,10)/p-1
InChIKeyXJVJDQJDLXVANA-UHFFFAOYSA-M
MW283.01 g/mol
LogP0.40
Rot. Bonds1

About hydroxy-phenyl-selanylidene-selenido-λ5-phosphane

hydroxy-phenyl-selanylidene-selenido-λ5-phosphane (PubChem CID 139152128) has the molecular formula C6H6OPSe2- and a molecular weight of 283.01 g/mol. Its IUPAC name is hydroxy-phenyl-selanylidene-selenido-λ5-phosphane.

Molecular Properties

Compound Namehydroxy-phenyl-selanylidene-selenido-λ5-phosphane
PubChem CID139152128
Molecular FormulaC6H6OPSe2-
Molecular Weight283.01 g/mol
Exact Mass284.85
IUPAC Namehydroxy-phenyl-selanylidene-selenido-λ5-phosphane
SMILESO[P@@](=[Se])([Se-])c1ccccc1
InChIInChI=1S/C6H7OPSe2/c7-8(9,10)6-4-2-1-3-5-6/h1-5H,(H2,7,9,10)/p-1
InChIKeyXJVJDQJDLXVANA-UHFFFAOYSA-M
XLogP0.40
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.01
LogP ≤ 50.40
H-Bond Donors ≤ 51
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 hydroxy-phenyl-selanylidene-selenido-λ5-phosphane?
The IUPAC name of hydroxy-phenyl-selanylidene-selenido-λ5-phosphane (CID 139152128) is hydroxy-phenyl-selanylidene-selenido-λ5-phosphane.
What is the SMILES notation for hydroxy-phenyl-selanylidene-selenido-λ5-phosphane?
The canonical SMILES for hydroxy-phenyl-selanylidene-selenido-λ5-phosphane is O[P@@](=[Se])([Se-])c1ccccc1.
What is the InChIKey of hydroxy-phenyl-selanylidene-selenido-λ5-phosphane?
The InChIKey is XJVJDQJDLXVANA-UHFFFAOYSA-M. The full InChI is InChI=1S/C6H7OPSe2/c7-8(9,10)6-4-2-1-3-5-6/h1-5H,(H2,7,9,10)/p-1.
What are the key properties of hydroxy-phenyl-selanylidene-selenido-λ5-phosphane?
hydroxy-phenyl-selanylidene-selenido-λ5-phosphane has a molecular weight of 283.01 g/mol, XLogP of 0.40, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for hydroxy-phenyl-selanylidene-selenido-λ5-phosphane is sourced from PubChem (CID 139152128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).