(2,3,4,5,6-pentafluorophenyl)imino-triphenyl-λ5-phosphane

C24H15F5NP — CID 71362132

IUPAC(2,3,4,5,6-pentafluorophenyl)imino-triphenyl-λ5-phosphane
SMILESFc1c(F)c(F)c(N=P(c2ccccc2)(c2ccccc2)c2ccccc2)c(F)c1F
InChIInChI=1S/C24H15F5NP/c25-19-20(26)22(28)24(23(29)21(19)27)30-31(16-10-4-1-5-11-16,17-12-6-2-7-13-17)18-14-8-3-9-15-18/h1-15H
InChIKeyZODPGDCLTVGTCN-UHFFFAOYSA-N
MW443.36 g/mol
LogP6.19
Rot. Bonds4

About (2,3,4,5,6-pentafluorophenyl)imino-triphenyl-λ5-phosphane

(2,3,4,5,6-pentafluorophenyl)imino-triphenyl-λ5-phosphane (PubChem CID 71362132) has the molecular formula C24H15F5NP and a molecular weight of 443.36 g/mol. Its IUPAC name is (2,3,4,5,6-pentafluorophenyl)imino-triphenyl-λ5-phosphane.

Molecular Properties

Compound Name(2,3,4,5,6-pentafluorophenyl)imino-triphenyl-λ5-phosphane
PubChem CID71362132
Molecular FormulaC24H15F5NP
Molecular Weight443.36 g/mol
Exact Mass443.09
IUPAC Name(2,3,4,5,6-pentafluorophenyl)imino-triphenyl-λ5-phosphane
SMILESFc1c(F)c(F)c(N=P(c2ccccc2)(c2ccccc2)c2ccccc2)c(F)c1F
InChIInChI=1S/C24H15F5NP/c25-19-20(26)22(28)24(23(29)21(19)27)30-31(16-10-4-1-5-11-16,17-12-6-2-7-13-17)18-14-8-3-9-15-18/h1-15H
InChIKeyZODPGDCLTVGTCN-UHFFFAOYSA-N
XLogP6.19
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500443.36
LogP ≤ 56.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'halogenated_ring_1', 'substructure': 'N/A'}, {'alert_name': 'halogenated_ring_2', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

Analyze (2,3,4,5,6-pentafluorophenyl)imino-triphenyl-λ5-phosphane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (2,3,4,5,6-pentafluorophenyl)imino-triphenyl-λ5-phosphane?
The IUPAC name of (2,3,4,5,6-pentafluorophenyl)imino-triphenyl-λ5-phosphane (CID 71362132) is (2,3,4,5,6-pentafluorophenyl)imino-triphenyl-λ5-phosphane.
What is the SMILES notation for (2,3,4,5,6-pentafluorophenyl)imino-triphenyl-λ5-phosphane?
The canonical SMILES for (2,3,4,5,6-pentafluorophenyl)imino-triphenyl-λ5-phosphane is Fc1c(F)c(F)c(N=P(c2ccccc2)(c2ccccc2)c2ccccc2)c(F)c1F.
What is the InChIKey of (2,3,4,5,6-pentafluorophenyl)imino-triphenyl-λ5-phosphane?
The InChIKey is ZODPGDCLTVGTCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H15F5NP/c25-19-20(26)22(28)24(23(29)21(19)27)30-31(16-10-4-1-5-11-16,17-12-6-2-7-13-17)18-14-8-3-9-15-18/h1-15H.
What are the key properties of (2,3,4,5,6-pentafluorophenyl)imino-triphenyl-λ5-phosphane?
(2,3,4,5,6-pentafluorophenyl)imino-triphenyl-λ5-phosphane has a molecular weight of 443.36 g/mol, XLogP of 6.19, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2,3,4,5,6-pentafluorophenyl)imino-triphenyl-λ5-phosphane is sourced from PubChem (CID 71362132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).