[3-fluoro-4-(4-phosphanylphenyl)phenyl]phosphane

C12H11FP2 — CID 144647906

IUPAC[3-fluoro-4-(4-phosphanylphenyl)phenyl]phosphane
SMILESFc1cc(P)ccc1-c1ccc(P)cc1
InChIInChI=1S/C12H11FP2/c13-12-7-10(15)5-6-11(12)8-1-3-9(14)4-2-8/h1-7H,14-15H2
InChIKeySXACWECVXKTOKW-UHFFFAOYSA-N
MW236.17 g/mol
LogP2.49
Rot. Bonds1

About [3-fluoro-4-(4-phosphanylphenyl)phenyl]phosphane

[3-fluoro-4-(4-phosphanylphenyl)phenyl]phosphane (PubChem CID 144647906) has the molecular formula C12H11FP2 and a molecular weight of 236.17 g/mol. Its IUPAC name is [3-fluoro-4-(4-phosphanylphenyl)phenyl]phosphane.

Molecular Properties

Compound Name[3-fluoro-4-(4-phosphanylphenyl)phenyl]phosphane
PubChem CID144647906
Molecular FormulaC12H11FP2
Molecular Weight236.17 g/mol
Exact Mass236.03
IUPAC Name[3-fluoro-4-(4-phosphanylphenyl)phenyl]phosphane
SMILESFc1cc(P)ccc1-c1ccc(P)cc1
InChIInChI=1S/C12H11FP2/c13-12-7-10(15)5-6-11(12)8-1-3-9(14)4-2-8/h1-7H,14-15H2
InChIKeySXACWECVXKTOKW-UHFFFAOYSA-N
XLogP2.49
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.17
LogP ≤ 52.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [3-fluoro-4-(4-phosphanylphenyl)phenyl]phosphane?
The IUPAC name of [3-fluoro-4-(4-phosphanylphenyl)phenyl]phosphane (CID 144647906) is [3-fluoro-4-(4-phosphanylphenyl)phenyl]phosphane.
What is the SMILES notation for [3-fluoro-4-(4-phosphanylphenyl)phenyl]phosphane?
The canonical SMILES for [3-fluoro-4-(4-phosphanylphenyl)phenyl]phosphane is Fc1cc(P)ccc1-c1ccc(P)cc1.
What is the InChIKey of [3-fluoro-4-(4-phosphanylphenyl)phenyl]phosphane?
The InChIKey is SXACWECVXKTOKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11FP2/c13-12-7-10(15)5-6-11(12)8-1-3-9(14)4-2-8/h1-7H,14-15H2.
What are the key properties of [3-fluoro-4-(4-phosphanylphenyl)phenyl]phosphane?
[3-fluoro-4-(4-phosphanylphenyl)phenyl]phosphane has a molecular weight of 236.17 g/mol, XLogP of 2.49, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [3-fluoro-4-(4-phosphanylphenyl)phenyl]phosphane is sourced from PubChem (CID 144647906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).