[2-(2-bromophenyl)-3-chlorophenyl]-bis(4-fluorophenyl)phosphane

C24H15BrClF2P — CID 132851214

IUPAC[2-(2-bromophenyl)-3-chlorophenyl]-bis(4-fluorophenyl)phosphane
SMILESFc1ccc(P(c2ccc(F)cc2)c2cccc(Cl)c2-c2ccccc2Br)cc1
InChIInChI=1S/C24H15BrClF2P/c25-21-5-2-1-4-20(21)24-22(26)6-3-7-23(24)29(18-12-8-16(27)9-13-18)19-14-10-17(28)11-15-19/h1-15H
InChIKeyHVJVRZGWNRQGBO-UHFFFAOYSA-N
MW487.71 g/mol
LogP6.81
Rot. Bonds4

About [2-(2-bromophenyl)-3-chlorophenyl]-bis(4-fluorophenyl)phosphane

[2-(2-bromophenyl)-3-chlorophenyl]-bis(4-fluorophenyl)phosphane (PubChem CID 132851214) has the molecular formula C24H15BrClF2P and a molecular weight of 487.71 g/mol. Its IUPAC name is [2-(2-bromophenyl)-3-chlorophenyl]-bis(4-fluorophenyl)phosphane.

Molecular Properties

Compound Name[2-(2-bromophenyl)-3-chlorophenyl]-bis(4-fluorophenyl)phosphane
PubChem CID132851214
Molecular FormulaC24H15BrClF2P
Molecular Weight487.71 g/mol
Exact Mass485.98
IUPAC Name[2-(2-bromophenyl)-3-chlorophenyl]-bis(4-fluorophenyl)phosphane
SMILESFc1ccc(P(c2ccc(F)cc2)c2cccc(Cl)c2-c2ccccc2Br)cc1
InChIInChI=1S/C24H15BrClF2P/c25-21-5-2-1-4-20(21)24-22(26)6-3-7-23(24)29(18-12-8-16(27)9-13-18)19-14-10-17(28)11-15-19/h1-15H
InChIKeyHVJVRZGWNRQGBO-UHFFFAOYSA-N
XLogP6.81
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500487.71
LogP ≤ 56.81
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 [2-(2-bromophenyl)-3-chlorophenyl]-bis(4-fluorophenyl)phosphane?
The IUPAC name of [2-(2-bromophenyl)-3-chlorophenyl]-bis(4-fluorophenyl)phosphane (CID 132851214) is [2-(2-bromophenyl)-3-chlorophenyl]-bis(4-fluorophenyl)phosphane.
What is the SMILES notation for [2-(2-bromophenyl)-3-chlorophenyl]-bis(4-fluorophenyl)phosphane?
The canonical SMILES for [2-(2-bromophenyl)-3-chlorophenyl]-bis(4-fluorophenyl)phosphane is Fc1ccc(P(c2ccc(F)cc2)c2cccc(Cl)c2-c2ccccc2Br)cc1.
What is the InChIKey of [2-(2-bromophenyl)-3-chlorophenyl]-bis(4-fluorophenyl)phosphane?
The InChIKey is HVJVRZGWNRQGBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H15BrClF2P/c25-21-5-2-1-4-20(21)24-22(26)6-3-7-23(24)29(18-12-8-16(27)9-13-18)19-14-10-17(28)11-15-19/h1-15H.
What are the key properties of [2-(2-bromophenyl)-3-chlorophenyl]-bis(4-fluorophenyl)phosphane?
[2-(2-bromophenyl)-3-chlorophenyl]-bis(4-fluorophenyl)phosphane has a molecular weight of 487.71 g/mol, XLogP of 6.81, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-bromophenyl)-3-chlorophenyl]-bis(4-fluorophenyl)phosphane is sourced from PubChem (CID 132851214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).