oxo-phenoxy-phosphonooxyphosphanium;zirconium

C6H7O6P2Zr+ — CID 90015245

IUPACoxo-phenoxy-phosphonooxyphosphanium;zirconium
SMILESO=[P+](Oc1ccccc1)OP(=O)(O)O.[Zr]
InChIInChI=1S/C6H6O6P2.Zr/c7-13(12-14(8,9)10)11-6-4-2-1-3-5-6;/h1-5H,(H-,8,9,10);/p+1
InChIKeyZXOJRAPBOYOQPN-UHFFFAOYSA-O
MW328.29 g/mol
LogP1.83
Rot. Bonds4

About oxo-phenoxy-phosphonooxyphosphanium;zirconium

oxo-phenoxy-phosphonooxyphosphanium;zirconium (PubChem CID 90015245) has the molecular formula C6H7O6P2Zr+ and a molecular weight of 328.29 g/mol. Its IUPAC name is oxo-phenoxy-phosphonooxyphosphanium;zirconium.

Molecular Properties

Compound Nameoxo-phenoxy-phosphonooxyphosphanium;zirconium
PubChem CID90015245
Molecular FormulaC6H7O6P2Zr+
Molecular Weight328.29 g/mol
Exact Mass326.88
IUPAC Nameoxo-phenoxy-phosphonooxyphosphanium;zirconium
SMILESO=[P+](Oc1ccccc1)OP(=O)(O)O.[Zr]
InChIInChI=1S/C6H6O6P2.Zr/c7-13(12-14(8,9)10)11-6-4-2-1-3-5-6;/h1-5H,(H-,8,9,10);/p+1
InChIKeyZXOJRAPBOYOQPN-UHFFFAOYSA-O
XLogP1.83
TPSA93.06 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.29
LogP ≤ 51.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

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CID 158842365
cobalt;oxo(diphenoxy)phosphanium
CID 162036820
oxo-phenoxy-sulfinooxyphosphanium
CID 69029369
[4-(4-diphenoxyphosphoryloxyphenyl)phenoxy]-oxo-phenoxyphosphanium
CID 59104469
diphenyl hydrogen phosphite;oxo(diphenoxy)phosphanium
CID 87382332
CID 131875092
CID 131875092
oxo-[3-[[3-[oxo(phenoxy)phosphaniumyl]oxyphenoxy]-phenoxyphosphoryl]oxyphenoxy]-phenoxyphosphanium
CID 20712633
oxido-oxo-phenoxyphosphanium;zirconium(4+);phosphate
CID 90015244
ethenoxy-oxo-phenoxyphosphanium
CID 57202191
oxo-phenoxy-phosphanylphosphanium
CID 154139481
[3-[(3-hydroxyphenoxy)-phenoxyphosphoryl]oxyphenoxy]-oxo-phenoxyphosphanium
CID 59089948
cesium phenyl hydrogen phosphate
CID 175568082

Frequently Asked Questions

What is the IUPAC name of oxo-phenoxy-phosphonooxyphosphanium;zirconium?
The IUPAC name of oxo-phenoxy-phosphonooxyphosphanium;zirconium (CID 90015245) is oxo-phenoxy-phosphonooxyphosphanium;zirconium.
What is the SMILES notation for oxo-phenoxy-phosphonooxyphosphanium;zirconium?
The canonical SMILES for oxo-phenoxy-phosphonooxyphosphanium;zirconium is O=[P+](Oc1ccccc1)OP(=O)(O)O.[Zr].
What is the InChIKey of oxo-phenoxy-phosphonooxyphosphanium;zirconium?
The InChIKey is ZXOJRAPBOYOQPN-UHFFFAOYSA-O. The full InChI is InChI=1S/C6H6O6P2.Zr/c7-13(12-14(8,9)10)11-6-4-2-1-3-5-6;/h1-5H,(H-,8,9,10);/p+1.
What are the key properties of oxo-phenoxy-phosphonooxyphosphanium;zirconium?
oxo-phenoxy-phosphonooxyphosphanium;zirconium has a molecular weight of 328.29 g/mol, XLogP of 1.83, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for oxo-phenoxy-phosphonooxyphosphanium;zirconium is sourced from PubChem (CID 90015245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).