benzenediazonium hexafluorophosphate

C6H5F6N2P — CID 9717

IUPACbenzenediazonium hexafluorophosphate
SMILESF[P-](F)(F)(F)(F)F.N#[N+]c1ccccc1
InChIInChI=1S/C6H5N2.F6P/c7-8-6-4-2-1-3-5-6;1-7(2,3,4,5)6/h1-5H;/q+1;-1
InChIKeyGIDPFONPWSEBOB-UHFFFAOYSA-N
MW250.08 g/mol
LogP5.55
Rot. Bonds

About benzenediazonium hexafluorophosphate

benzenediazonium hexafluorophosphate (PubChem CID 9717) has the molecular formula C6H5F6N2P and a molecular weight of 250.08 g/mol. Its IUPAC name is benzenediazonium hexafluorophosphate.

Molecular Properties

Compound Namebenzenediazonium hexafluorophosphate
PubChem CID9717
Molecular FormulaC6H5F6N2P
Molecular Weight250.08 g/mol
Exact Mass250.01
IUPAC Namebenzenediazonium hexafluorophosphate
SMILESF[P-](F)(F)(F)(F)F.N#[N+]c1ccccc1
InChIInChI=1S/C6H5N2.F6P/c7-8-6-4-2-1-3-5-6;1-7(2,3,4,5)6/h1-5H;/q+1;-1
InChIKeyGIDPFONPWSEBOB-UHFFFAOYSA-N
XLogP5.55
TPSA28.15 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500250.08
LogP ≤ 55.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of benzenediazonium hexafluorophosphate?
The IUPAC name of benzenediazonium hexafluorophosphate (CID 9717) is benzenediazonium hexafluorophosphate.
What is the SMILES notation for benzenediazonium hexafluorophosphate?
The canonical SMILES for benzenediazonium hexafluorophosphate is F[P-](F)(F)(F)(F)F.N#[N+]c1ccccc1.
What is the InChIKey of benzenediazonium hexafluorophosphate?
The InChIKey is GIDPFONPWSEBOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5N2.F6P/c7-8-6-4-2-1-3-5-6;1-7(2,3,4,5)6/h1-5H;/q+1;-1.
What are the key properties of benzenediazonium hexafluorophosphate?
benzenediazonium hexafluorophosphate has a molecular weight of 250.08 g/mol, XLogP of 5.55, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for benzenediazonium hexafluorophosphate is sourced from PubChem (CID 9717), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).