(5-fluorocyclopenta-1,3-dien-1-yl)-diphenylphosphane

C17H14FP — CID 176541891

IUPAC(5-fluorocyclopenta-1,3-dien-1-yl)-diphenylphosphane
SMILESFC1C=CC=C1P(c1ccccc1)c1ccccc1
InChIInChI=1S/C17H14FP/c18-16-12-7-13-17(16)19(14-8-3-1-4-9-14)15-10-5-2-6-11-15/h1-13,16H
InChIKeyBJPFBJOIPAENOM-UHFFFAOYSA-N
MW268.27 g/mol
LogP3.91
Rot. Bonds3

About (5-fluorocyclopenta-1,3-dien-1-yl)-diphenylphosphane

(5-fluorocyclopenta-1,3-dien-1-yl)-diphenylphosphane (PubChem CID 176541891) has the molecular formula C17H14FP and a molecular weight of 268.27 g/mol. Its IUPAC name is (5-fluorocyclopenta-1,3-dien-1-yl)-diphenylphosphane.

Molecular Properties

Compound Name(5-fluorocyclopenta-1,3-dien-1-yl)-diphenylphosphane
PubChem CID176541891
Molecular FormulaC17H14FP
Molecular Weight268.27 g/mol
Exact Mass268.08
IUPAC Name(5-fluorocyclopenta-1,3-dien-1-yl)-diphenylphosphane
SMILESFC1C=CC=C1P(c1ccccc1)c1ccccc1
InChIInChI=1S/C17H14FP/c18-16-12-7-13-17(16)19(14-8-3-1-4-9-14)15-10-5-2-6-11-15/h1-13,16H
InChIKeyBJPFBJOIPAENOM-UHFFFAOYSA-N
XLogP3.91
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.27
LogP ≤ 53.91
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

(2-diphenylphosphanylcyclopenta-2,4-dien-1-yl)methyl-diphenylphosphane
CID 16691563
(5-tert-butylsulfanylcyclopenta-1,3-dien-1-yl)-diphenylphosphane
CID 102357317
[5-(ethoxymethyl)cyclopenta-1,3-dien-1-yl]-diphenylphosphane
CID 176546157
(1R)-N-diphenylphosphanyl-1-(2-diphenylphosphanylcyclopenta-2,4-dien-1-yl)ethanamine
CID 87789367
benzyl-[(2-diphenylphosphanylcyclopenta-2,4-dien-1-yl)methyl]-dimethylazanium
CID 101238580
nickel(2+);tris(triphenylphosphane);diiodide
CID 173453506
triphenylphosphane
CID 139056248
(1R)-1-(2-diphenylphosphanylcyclopenta-2,4-dien-1-yl)-N-[(1S)-1-phenylethyl]ethanamine
CID 87708719
dicyclohexyl-[1-(2-diphenylphosphanylcyclopenta-2,4-dien-1-yl)ethyl]phosphane
CID 15302428
pentakis(palladium);hexadecakis(triphenylphosphane)
CID 173116735
palladium;bis(triphenylphosphane)
CID 10122028
tris(triphenylphosphane);trihydrochloride
CID 173282987

Frequently Asked Questions

What is the IUPAC name of (5-fluorocyclopenta-1,3-dien-1-yl)-diphenylphosphane?
The IUPAC name of (5-fluorocyclopenta-1,3-dien-1-yl)-diphenylphosphane (CID 176541891) is (5-fluorocyclopenta-1,3-dien-1-yl)-diphenylphosphane.
What is the SMILES notation for (5-fluorocyclopenta-1,3-dien-1-yl)-diphenylphosphane?
The canonical SMILES for (5-fluorocyclopenta-1,3-dien-1-yl)-diphenylphosphane is FC1C=CC=C1P(c1ccccc1)c1ccccc1.
What is the InChIKey of (5-fluorocyclopenta-1,3-dien-1-yl)-diphenylphosphane?
The InChIKey is BJPFBJOIPAENOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14FP/c18-16-12-7-13-17(16)19(14-8-3-1-4-9-14)15-10-5-2-6-11-15/h1-13,16H.
What are the key properties of (5-fluorocyclopenta-1,3-dien-1-yl)-diphenylphosphane?
(5-fluorocyclopenta-1,3-dien-1-yl)-diphenylphosphane has a molecular weight of 268.27 g/mol, XLogP of 3.91, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (5-fluorocyclopenta-1,3-dien-1-yl)-diphenylphosphane is sourced from PubChem (CID 176541891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).