(2,3,4,5,6-pentafluorophenyl)-triphenylplumbane

C24H15F5Pb — CID 4613552

IUPAC(2,3,4,5,6-pentafluorophenyl)-triphenylplumbane
SMILESFc1c(F)c(F)c([Pb](c2ccccc2)(c2ccccc2)c2ccccc2)c(F)c1F
InChIInChI=1S/C6F5.3C6H5.Pb/c7-2-1-3(8)5(10)6(11)4(2)9;3*1-2-4-6-5-3-1;/h;3*1-5H;
InChIKeySXSRSTVJJBQSEL-UHFFFAOYSA-N
MW605.57 g/mol
LogP3.76
Rot. Bonds4

About (2,3,4,5,6-pentafluorophenyl)-triphenylplumbane

(2,3,4,5,6-pentafluorophenyl)-triphenylplumbane (PubChem CID 4613552) has the molecular formula C24H15F5Pb and a molecular weight of 605.57 g/mol. Its IUPAC name is (2,3,4,5,6-pentafluorophenyl)-triphenylplumbane.

Molecular Properties

Compound Name(2,3,4,5,6-pentafluorophenyl)-triphenylplumbane
PubChem CID4613552
Molecular FormulaC24H15F5Pb
Molecular Weight605.57 g/mol
Exact Mass606.09
IUPAC Name(2,3,4,5,6-pentafluorophenyl)-triphenylplumbane
SMILESFc1c(F)c(F)c([Pb](c2ccccc2)(c2ccccc2)c2ccccc2)c(F)c1F
InChIInChI=1S/C6F5.3C6H5.Pb/c7-2-1-3(8)5(10)6(11)4(2)9;3*1-2-4-6-5-3-1;/h;3*1-5H;
InChIKeySXSRSTVJJBQSEL-UHFFFAOYSA-N
XLogP3.76
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500605.57
LogP ≤ 53.76
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'}

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Frequently Asked Questions

What is the IUPAC name of (2,3,4,5,6-pentafluorophenyl)-triphenylplumbane?
The IUPAC name of (2,3,4,5,6-pentafluorophenyl)-triphenylplumbane (CID 4613552) is (2,3,4,5,6-pentafluorophenyl)-triphenylplumbane.
What is the SMILES notation for (2,3,4,5,6-pentafluorophenyl)-triphenylplumbane?
The canonical SMILES for (2,3,4,5,6-pentafluorophenyl)-triphenylplumbane is Fc1c(F)c(F)c([Pb](c2ccccc2)(c2ccccc2)c2ccccc2)c(F)c1F.
What is the InChIKey of (2,3,4,5,6-pentafluorophenyl)-triphenylplumbane?
The InChIKey is SXSRSTVJJBQSEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C6F5.3C6H5.Pb/c7-2-1-3(8)5(10)6(11)4(2)9;3*1-2-4-6-5-3-1;/h;3*1-5H;.
What are the key properties of (2,3,4,5,6-pentafluorophenyl)-triphenylplumbane?
(2,3,4,5,6-pentafluorophenyl)-triphenylplumbane has a molecular weight of 605.57 g/mol, XLogP of 3.76, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (2,3,4,5,6-pentafluorophenyl)-triphenylplumbane is sourced from PubChem (CID 4613552), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).