dichloro-(2,3,4,5,6-pentafluorophenyl)phosphane

C6Cl2F5P — CID 12619469

IUPACdichloro-(2,3,4,5,6-pentafluorophenyl)phosphane
SMILESFc1c(F)c(F)c(P(Cl)Cl)c(F)c1F
InChIInChI=1S/C6Cl2F5P/c7-14(8)6-4(12)2(10)1(9)3(11)5(6)13
InChIKeyQJZOVDPHILFRTD-UHFFFAOYSA-N
MW268.94 g/mol
LogP3.80
Rot. Bonds1

About dichloro-(2,3,4,5,6-pentafluorophenyl)phosphane

dichloro-(2,3,4,5,6-pentafluorophenyl)phosphane (PubChem CID 12619469) has the molecular formula C6Cl2F5P and a molecular weight of 268.94 g/mol. Its IUPAC name is dichloro-(2,3,4,5,6-pentafluorophenyl)phosphane.

Molecular Properties

Compound Namedichloro-(2,3,4,5,6-pentafluorophenyl)phosphane
PubChem CID12619469
Molecular FormulaC6Cl2F5P
Molecular Weight268.94 g/mol
Exact Mass267.90
IUPAC Namedichloro-(2,3,4,5,6-pentafluorophenyl)phosphane
SMILESFc1c(F)c(F)c(P(Cl)Cl)c(F)c1F
InChIInChI=1S/C6Cl2F5P/c7-14(8)6-4(12)2(10)1(9)3(11)5(6)13
InChIKeyQJZOVDPHILFRTD-UHFFFAOYSA-N
XLogP3.80
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.94
LogP ≤ 53.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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'}

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Frequently Asked Questions

What is the IUPAC name of dichloro-(2,3,4,5,6-pentafluorophenyl)phosphane?
The IUPAC name of dichloro-(2,3,4,5,6-pentafluorophenyl)phosphane (CID 12619469) is dichloro-(2,3,4,5,6-pentafluorophenyl)phosphane.
What is the SMILES notation for dichloro-(2,3,4,5,6-pentafluorophenyl)phosphane?
The canonical SMILES for dichloro-(2,3,4,5,6-pentafluorophenyl)phosphane is Fc1c(F)c(F)c(P(Cl)Cl)c(F)c1F.
What is the InChIKey of dichloro-(2,3,4,5,6-pentafluorophenyl)phosphane?
The InChIKey is QJZOVDPHILFRTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C6Cl2F5P/c7-14(8)6-4(12)2(10)1(9)3(11)5(6)13.
What are the key properties of dichloro-(2,3,4,5,6-pentafluorophenyl)phosphane?
dichloro-(2,3,4,5,6-pentafluorophenyl)phosphane has a molecular weight of 268.94 g/mol, XLogP of 3.80, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dichloro-(2,3,4,5,6-pentafluorophenyl)phosphane is sourced from PubChem (CID 12619469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).