2-fluoren-9-ylideneethyl(triphenyl)phosphanium

C33H26P+ — CID 178187513

IUPAC2-fluoren-9-ylideneethyl(triphenyl)phosphanium
SMILESC(C[P+](c1ccccc1)(c1ccccc1)c1ccccc1)=C1c2ccccc2-c2ccccc21
InChIInChI=1S/C33H26P/c1-4-14-26(15-5-1)34(27-16-6-2-7-17-27,28-18-8-3-9-19-28)25-24-33-31-22-12-10-20-29(31)30-21-11-13-23-32(30)33/h1-24H,25H2/q+1
InChIKeyXPSORPOQZCOFKI-UHFFFAOYSA-N
MW453.55 g/mol
LogP7.09
Rot. Bonds5

About 2-fluoren-9-ylideneethyl(triphenyl)phosphanium

2-fluoren-9-ylideneethyl(triphenyl)phosphanium (PubChem CID 178187513) has the molecular formula C33H26P+ and a molecular weight of 453.55 g/mol. Its IUPAC name is 2-fluoren-9-ylideneethyl(triphenyl)phosphanium.

Molecular Properties

Compound Name2-fluoren-9-ylideneethyl(triphenyl)phosphanium
PubChem CID178187513
Molecular FormulaC33H26P+
Molecular Weight453.55 g/mol
Exact Mass453.18
IUPAC Name2-fluoren-9-ylideneethyl(triphenyl)phosphanium
SMILESC(C[P+](c1ccccc1)(c1ccccc1)c1ccccc1)=C1c2ccccc2-c2ccccc21
InChIInChI=1S/C33H26P/c1-4-14-26(15-5-1)34(27-16-6-2-7-17-27,28-18-8-3-9-19-28)25-24-33-31-22-12-10-20-29(31)30-21-11-13-23-32(30)33/h1-24H,25H2/q+1
InChIKeyXPSORPOQZCOFKI-UHFFFAOYSA-N
XLogP7.09
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500453.55
LogP ≤ 57.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

[(E)-but-2-enyl]-triphenylphosphanium iodide
CID 19366382
[(E)-4-hydroxybut-2-enyl]-triphenylphosphanium
CID 10894920
3-iminoprop-2-enyl(triphenyl)phosphanium
CID 139243695
triphenyl-[(Z)-4-phenylbut-2-enyl]phosphanium
CID 11283206
triphenyl(prop-2-enyl)phosphanium perchlorate
CID 21492296
[(E)-4-bromobut-2-enyl]-triphenylphosphanium;hydrobromide
CID 20833566
14-(3-bromopropylidene)tetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8,10,12,15,17-nonaene
CID 18917166
penta-2,4-dienyl(triphenyl)phosphanium bromide
CID 72767674
palladium;triphenyl(2-triphenylphosphaniumylethyl)phosphanium
CID 87290696
triphenyl(2-triphenylphosphaniumylethyl)phosphanium dibromide
CID 2785215
[(2Z,4E)-hexa-2,4-dienyl]-triphenylphosphanium
CID 13156160
[(2Z,4Z)-hepta-2,4,6-trienyl]-triphenylphosphanium
CID 89336111

Frequently Asked Questions

What is the IUPAC name of 2-fluoren-9-ylideneethyl(triphenyl)phosphanium?
The IUPAC name of 2-fluoren-9-ylideneethyl(triphenyl)phosphanium (CID 178187513) is 2-fluoren-9-ylideneethyl(triphenyl)phosphanium.
What is the SMILES notation for 2-fluoren-9-ylideneethyl(triphenyl)phosphanium?
The canonical SMILES for 2-fluoren-9-ylideneethyl(triphenyl)phosphanium is C(C[P+](c1ccccc1)(c1ccccc1)c1ccccc1)=C1c2ccccc2-c2ccccc21.
What is the InChIKey of 2-fluoren-9-ylideneethyl(triphenyl)phosphanium?
The InChIKey is XPSORPOQZCOFKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H26P/c1-4-14-26(15-5-1)34(27-16-6-2-7-17-27,28-18-8-3-9-19-28)25-24-33-31-22-12-10-20-29(31)30-21-11-13-23-32(30)33/h1-24H,25H2/q+1.
What are the key properties of 2-fluoren-9-ylideneethyl(triphenyl)phosphanium?
2-fluoren-9-ylideneethyl(triphenyl)phosphanium has a molecular weight of 453.55 g/mol, XLogP of 7.09, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoren-9-ylideneethyl(triphenyl)phosphanium is sourced from PubChem (CID 178187513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).