oxo-phenoxy-phosphanylphosphanium

C6H7O2P2+ — CID 154139481

IUPACoxo-phenoxy-phosphanylphosphanium
SMILESO=[P+](P)Oc1ccccc1
InChIInChI=1S/C6H7O2P2/c7-10(9)8-6-4-2-1-3-5-6/h1-5H,9H2/q+1
InChIKeyODMCFDXSUAPLNY-UHFFFAOYSA-N
MW173.07 g/mol
LogP2.60
Rot. Bonds2

About oxo-phenoxy-phosphanylphosphanium

oxo-phenoxy-phosphanylphosphanium (PubChem CID 154139481) has the molecular formula C6H7O2P2+ and a molecular weight of 173.07 g/mol. Its IUPAC name is oxo-phenoxy-phosphanylphosphanium.

Molecular Properties

Compound Nameoxo-phenoxy-phosphanylphosphanium
PubChem CID154139481
Molecular FormulaC6H7O2P2+
Molecular Weight173.07 g/mol
Exact Mass172.99
IUPAC Nameoxo-phenoxy-phosphanylphosphanium
SMILESO=[P+](P)Oc1ccccc1
InChIInChI=1S/C6H7O2P2/c7-10(9)8-6-4-2-1-3-5-6/h1-5H,9H2/q+1
InChIKeyODMCFDXSUAPLNY-UHFFFAOYSA-N
XLogP2.60
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.07
LogP ≤ 52.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

copper;oxo(diphenoxy)phosphanium
CID 158842365
cobalt;oxo(diphenoxy)phosphanium
CID 162036820
copper(1+);oxido-oxo-phenoxyphosphanium
CID 166721703
2-aminoethyl-oxo-phenoxyphosphanium
CID 90917693
disodium;bis(oxido-oxo-phenoxyphosphanium);dihydrate
CID 71431251
magnesium;hydride;oxo-phenoxy-phenylphosphanium
CID 173003254
chloromethyl-oxo-phenoxyphosphanium
CID 174746789
cerium;ethyl-oxo-phenoxyphosphanium
CID 174771782
2-carboxyethyl-oxo-phenoxyphosphanium;zinc
CID 174937996
oxo-pentyl-phenoxyphosphanium
CID 67135329
ethenoxy-oxo-phenoxyphosphanium
CID 57202191
oxido-oxo-phenoxyphosphanium;zirconium(4+);phosphate
CID 90015244

Frequently Asked Questions

What is the IUPAC name of oxo-phenoxy-phosphanylphosphanium?
The IUPAC name of oxo-phenoxy-phosphanylphosphanium (CID 154139481) is oxo-phenoxy-phosphanylphosphanium.
What is the SMILES notation for oxo-phenoxy-phosphanylphosphanium?
The canonical SMILES for oxo-phenoxy-phosphanylphosphanium is O=[P+](P)Oc1ccccc1.
What is the InChIKey of oxo-phenoxy-phosphanylphosphanium?
The InChIKey is ODMCFDXSUAPLNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7O2P2/c7-10(9)8-6-4-2-1-3-5-6/h1-5H,9H2/q+1.
What are the key properties of oxo-phenoxy-phosphanylphosphanium?
oxo-phenoxy-phosphanylphosphanium has a molecular weight of 173.07 g/mol, XLogP of 2.60, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for oxo-phenoxy-phosphanylphosphanium is sourced from PubChem (CID 154139481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).