2,6-bis(4-fluorophenyl)pyrylium

C17H11F2O+ — CID 11824430

IUPAC2,6-bis(4-fluorophenyl)pyrylium
SMILESFc1ccc(-c2cccc(-c3ccc(F)cc3)[o+]2)cc1
InChIInChI=1S/C17H11F2O/c18-14-8-4-12(5-9-14)16-2-1-3-17(20-16)13-6-10-15(19)11-7-13/h1-11H/q+1
InChIKeyQCCMYGSROYBDNG-UHFFFAOYSA-N
MW269.27 g/mol
LogP5.17
Rot. Bonds2

About 2,6-bis(4-fluorophenyl)pyrylium

2,6-bis(4-fluorophenyl)pyrylium (PubChem CID 11824430) has the molecular formula C17H11F2O+ and a molecular weight of 269.27 g/mol. Its IUPAC name is 2,6-bis(4-fluorophenyl)pyrylium.

Molecular Properties

Compound Name2,6-bis(4-fluorophenyl)pyrylium
PubChem CID11824430
Molecular FormulaC17H11F2O+
Molecular Weight269.27 g/mol
Exact Mass269.08
IUPAC Name2,6-bis(4-fluorophenyl)pyrylium
SMILESFc1ccc(-c2cccc(-c3ccc(F)cc3)[o+]2)cc1
InChIInChI=1S/C17H11F2O/c18-14-8-4-12(5-9-14)16-2-1-3-17(20-16)13-6-10-15(19)11-7-13/h1-11H/q+1
InChIKeyQCCMYGSROYBDNG-UHFFFAOYSA-N
XLogP5.17
TPSA11.30 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500269.27
LogP ≤ 55.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

2,4-bis(4-fluorophenyl)-6-phenylpyrylium
CID 134911591
1-fluoro-4-[4-[4-[4-[4-[4-[4-(4-fluorophenyl)phenyl]phenyl]phenyl]phenyl]phenyl]phenyl]benzene
CID 58320925
1,3-bis(4-fluorophenyl)-2-methylbenzene
CID 58586629
1-fluoro-3-(4-fluorophenyl)-2-methylbenzene
CID 46313945
1,2-dichloro-3-(4-fluorophenyl)benzene
CID 57058690
5-(4-fluorophenyl)naphthalen-1-amine
CID 172677714
1,2-bis(4-fluorophenyl)acenaphthylene
CID 23635200
2-tert-butyl-4-(4-fluorophenyl)-6-phenylpyrylium
CID 134909177
1,3-difluorobenzene;1,4-difluorobenzene
CID 159873588
1-fluoro-4-(4-fluorophenyl)benzene;formaldehyde
CID 175463820
lithium;1-fluoro-4-phenylbenzene;hydride
CID 173443965
1,4-difluorobenzene bromide
CID 21301175

Frequently Asked Questions

What is the IUPAC name of 2,6-bis(4-fluorophenyl)pyrylium?
The IUPAC name of 2,6-bis(4-fluorophenyl)pyrylium (CID 11824430) is 2,6-bis(4-fluorophenyl)pyrylium.
What is the SMILES notation for 2,6-bis(4-fluorophenyl)pyrylium?
The canonical SMILES for 2,6-bis(4-fluorophenyl)pyrylium is Fc1ccc(-c2cccc(-c3ccc(F)cc3)[o+]2)cc1.
What is the InChIKey of 2,6-bis(4-fluorophenyl)pyrylium?
The InChIKey is QCCMYGSROYBDNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H11F2O/c18-14-8-4-12(5-9-14)16-2-1-3-17(20-16)13-6-10-15(19)11-7-13/h1-11H/q+1.
What are the key properties of 2,6-bis(4-fluorophenyl)pyrylium?
2,6-bis(4-fluorophenyl)pyrylium has a molecular weight of 269.27 g/mol, XLogP of 5.17, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-bis(4-fluorophenyl)pyrylium is sourced from PubChem (CID 11824430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).