chloro-(2-fluorophenyl)-phenylphosphane;(2-fluorophenyl)-phenylphosphane

C24H19ClF2P2 — CID 159834290

IUPACchloro-(2-fluorophenyl)-phenylphosphane;(2-fluorophenyl)-phenylphosphane
SMILESFc1ccccc1P(Cl)c1ccccc1.Fc1ccccc1Pc1ccccc1
InChIInChI=1S/C12H9ClFP.C12H10FP/c13-15(10-6-2-1-3-7-10)12-9-5-4-8-11(12)14;13-11-8-4-5-9-12(11)14-10-6-2-1-3-7-10/h1-9H;1-9,14H
InChIKeyNNVZIEVGOGFABG-UHFFFAOYSA-N
MW442.81 g/mol
LogP5.87
Rot. Bonds4

About chloro-(2-fluorophenyl)-phenylphosphane;(2-fluorophenyl)-phenylphosphane

chloro-(2-fluorophenyl)-phenylphosphane;(2-fluorophenyl)-phenylphosphane (PubChem CID 159834290) has the molecular formula C24H19ClF2P2 and a molecular weight of 442.81 g/mol. Its IUPAC name is chloro-(2-fluorophenyl)-phenylphosphane;(2-fluorophenyl)-phenylphosphane.

Molecular Properties

Compound Namechloro-(2-fluorophenyl)-phenylphosphane;(2-fluorophenyl)-phenylphosphane
PubChem CID159834290
Molecular FormulaC24H19ClF2P2
Molecular Weight442.81 g/mol
Exact Mass442.06
IUPAC Namechloro-(2-fluorophenyl)-phenylphosphane;(2-fluorophenyl)-phenylphosphane
SMILESFc1ccccc1P(Cl)c1ccccc1.Fc1ccccc1Pc1ccccc1
InChIInChI=1S/C12H9ClFP.C12H10FP/c13-15(10-6-2-1-3-7-10)12-9-5-4-8-11(12)14;13-11-8-4-5-9-12(11)14-10-6-2-1-3-7-10/h1-9H;1-9,14H
InChIKeyNNVZIEVGOGFABG-UHFFFAOYSA-N
XLogP5.87
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500442.81
LogP ≤ 55.87
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

(8-fluoronaphthalen-1-yl)-phenylphosphane;hydrochloride
CID 90011752
diphenyl-[2-[(2-phenylphosphanylphenyl)methyl]phenyl]phosphane
CID 137491605
1-[amino(phenyl)phosphanyl]-2-fluorobenzene
CID 155476393
methyl-phenyl-[2-(2-phenylphosphanylphenoxy)phenyl]phosphane
CID 122491107
diphenylphosphane;trichlororuthenium
CID 162065304
3,3-dimethylbut-1-ynyl-(2-fluorophenyl)-phenylphosphane
CID 150051409
copper(1+);diphenylphosphane;hydride;triphenylphosphane
CID 122655243
2-phenylphosphanylphenolate
CID 139104043
(2-fluorophenyl)-phenyl-[(E)-2,3,3-trimethylbut-1-enyl]phosphane
CID 161322688
diphenylphosphane;zinc
CID 160591319
bis(diphenylphosphane);zinc
CID 160732089
bis(diphenylphosphane);nickel
CID 172733587

Frequently Asked Questions

What is the IUPAC name of chloro-(2-fluorophenyl)-phenylphosphane;(2-fluorophenyl)-phenylphosphane?
The IUPAC name of chloro-(2-fluorophenyl)-phenylphosphane;(2-fluorophenyl)-phenylphosphane (CID 159834290) is chloro-(2-fluorophenyl)-phenylphosphane;(2-fluorophenyl)-phenylphosphane.
What is the SMILES notation for chloro-(2-fluorophenyl)-phenylphosphane;(2-fluorophenyl)-phenylphosphane?
The canonical SMILES for chloro-(2-fluorophenyl)-phenylphosphane;(2-fluorophenyl)-phenylphosphane is Fc1ccccc1P(Cl)c1ccccc1.Fc1ccccc1Pc1ccccc1.
What is the InChIKey of chloro-(2-fluorophenyl)-phenylphosphane;(2-fluorophenyl)-phenylphosphane?
The InChIKey is NNVZIEVGOGFABG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9ClFP.C12H10FP/c13-15(10-6-2-1-3-7-10)12-9-5-4-8-11(12)14;13-11-8-4-5-9-12(11)14-10-6-2-1-3-7-10/h1-9H;1-9,14H.
What are the key properties of chloro-(2-fluorophenyl)-phenylphosphane;(2-fluorophenyl)-phenylphosphane?
chloro-(2-fluorophenyl)-phenylphosphane;(2-fluorophenyl)-phenylphosphane has a molecular weight of 442.81 g/mol, XLogP of 5.87, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for chloro-(2-fluorophenyl)-phenylphosphane;(2-fluorophenyl)-phenylphosphane is sourced from PubChem (CID 159834290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).