2,4,6,6,8,8,10,10-octafluoro-1,3,5,7,9-pentaza-2λ5,4λ5,6λ5,8λ5,10λ5-pentaphosphacyclodeca-1,3,5,7,9-pentaene-2,4-dicarbaldehyde

C2H2F8N5O2P5 — CID 129015269

IUPAC2,4,6,6,8,8,10,10-octafluoro-1,3,5,7,9-pentaza-2λ5,4λ5,6λ5,8λ5,10λ5-pentaphosphacyclodeca-1,3,5,7,9-pentaene-2,4-dicarbaldehyde
SMILESO=CP1(F)=NP(F)(F)=NP(F)(F)=NP(F)(F)=NP(F)(C=O)=N1
InChIInChI=1S/C2H2F8N5O2P5/c3-18(1-16)11-19(4,2-17)13-21(7,8)15-22(9,10)14-20(5,6)12-18/h1-2H
InChIKeyPOUCGGPXKOXLFJ-UHFFFAOYSA-N
MW434.93 g/mol
LogP8.04
Rot. Bonds2

About 2,4,6,6,8,8,10,10-octafluoro-1,3,5,7,9-pentaza-2λ5,4λ5,6λ5,8λ5,10λ5-pentaphosphacyclodeca-1,3,5,7,9-pentaene-2,4-dicarbaldehyde

2,4,6,6,8,8,10,10-octafluoro-1,3,5,7,9-pentaza-2λ5,4λ5,6λ5,8λ5,10λ5-pentaphosphacyclodeca-1,3,5,7,9-pentaene-2,4-dicarbaldehyde (PubChem CID 129015269) has the molecular formula C2H2F8N5O2P5 and a molecular weight of 434.93 g/mol. Its IUPAC name is 2,4,6,6,8,8,10,10-octafluoro-1,3,5,7,9-pentaza-2λ5,4λ5,6λ5,8λ5,10λ5-pentaphosphacyclodeca-1,3,5,7,9-pentaene-2,4-dicarbaldehyde.

Molecular Properties

Compound Name2,4,6,6,8,8,10,10-octafluoro-1,3,5,7,9-pentaza-2λ5,4λ5,6λ5,8λ5,10λ5-pentaphosphacyclodeca-1,3,5,7,9-pentaene-2,4-dicarbaldehyde
PubChem CID129015269
Molecular FormulaC2H2F8N5O2P5
Molecular Weight434.93 g/mol
Exact Mass434.88
IUPAC Name2,4,6,6,8,8,10,10-octafluoro-1,3,5,7,9-pentaza-2λ5,4λ5,6λ5,8λ5,10λ5-pentaphosphacyclodeca-1,3,5,7,9-pentaene-2,4-dicarbaldehyde
SMILESO=CP1(F)=NP(F)(F)=NP(F)(F)=NP(F)(F)=NP(F)(C=O)=N1
InChIInChI=1S/C2H2F8N5O2P5/c3-18(1-16)11-19(4,2-17)13-21(7,8)15-22(9,10)14-20(5,6)12-18/h1-2H
InChIKeyPOUCGGPXKOXLFJ-UHFFFAOYSA-N
XLogP8.04
TPSA95.94 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500434.93
LogP ≤ 58.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

Analyze 2,4,6,6,8,8,10,10-octafluoro-1,3,5,7,9-pentaza-2λ5,4λ5,6λ5,8λ5,10λ5-pentaphosphacyclodeca-1,3,5,7,9-pentaene-2,4-dicarbaldehyde with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2,4,6,6,8,8,10,10-octafluoro-1,3,5,7,9-pentaza-2λ5,4λ5,6λ5,8λ5,10λ5-pentaphosphacyclodeca-1,3,5,7,9-pentaene-2,4-dicarbaldehyde?
The IUPAC name of 2,4,6,6,8,8,10,10-octafluoro-1,3,5,7,9-pentaza-2λ5,4λ5,6λ5,8λ5,10λ5-pentaphosphacyclodeca-1,3,5,7,9-pentaene-2,4-dicarbaldehyde (CID 129015269) is 2,4,6,6,8,8,10,10-octafluoro-1,3,5,7,9-pentaza-2λ5,4λ5,6λ5,8λ5,10λ5-pentaphosphacyclodeca-1,3,5,7,9-pentaene-2,4-dicarbaldehyde.
What is the SMILES notation for 2,4,6,6,8,8,10,10-octafluoro-1,3,5,7,9-pentaza-2λ5,4λ5,6λ5,8λ5,10λ5-pentaphosphacyclodeca-1,3,5,7,9-pentaene-2,4-dicarbaldehyde?
The canonical SMILES for 2,4,6,6,8,8,10,10-octafluoro-1,3,5,7,9-pentaza-2λ5,4λ5,6λ5,8λ5,10λ5-pentaphosphacyclodeca-1,3,5,7,9-pentaene-2,4-dicarbaldehyde is O=CP1(F)=NP(F)(F)=NP(F)(F)=NP(F)(F)=NP(F)(C=O)=N1.
What is the InChIKey of 2,4,6,6,8,8,10,10-octafluoro-1,3,5,7,9-pentaza-2λ5,4λ5,6λ5,8λ5,10λ5-pentaphosphacyclodeca-1,3,5,7,9-pentaene-2,4-dicarbaldehyde?
The InChIKey is POUCGGPXKOXLFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H2F8N5O2P5/c3-18(1-16)11-19(4,2-17)13-21(7,8)15-22(9,10)14-20(5,6)12-18/h1-2H.
What are the key properties of 2,4,6,6,8,8,10,10-octafluoro-1,3,5,7,9-pentaza-2λ5,4λ5,6λ5,8λ5,10λ5-pentaphosphacyclodeca-1,3,5,7,9-pentaene-2,4-dicarbaldehyde?
2,4,6,6,8,8,10,10-octafluoro-1,3,5,7,9-pentaza-2λ5,4λ5,6λ5,8λ5,10λ5-pentaphosphacyclodeca-1,3,5,7,9-pentaene-2,4-dicarbaldehyde has a molecular weight of 434.93 g/mol, XLogP of 8.04, 2 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4,6,6,8,8,10,10-octafluoro-1,3,5,7,9-pentaza-2λ5,4λ5,6λ5,8λ5,10λ5-pentaphosphacyclodeca-1,3,5,7,9-pentaene-2,4-dicarbaldehyde is sourced from PubChem (CID 129015269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).