1,8-bis(4-fluorophenyl)naphthalene

C22H14F2 — CID 123918209

IUPAC1,8-bis(4-fluorophenyl)naphthalene
SMILESFc1ccc(-c2cccc3cccc(-c4ccc(F)cc4)c23)cc1
InChIInChI=1S/C22H14F2/c23-18-11-7-15(8-12-18)20-5-1-3-17-4-2-6-21(22(17)20)16-9-13-19(24)14-10-16/h1-14H
InChIKeyXCURNERJZKSOLU-UHFFFAOYSA-N
MW316.35 g/mol
LogP6.45
Rot. Bonds2

About 1,8-bis(4-fluorophenyl)naphthalene

1,8-bis(4-fluorophenyl)naphthalene (PubChem CID 123918209) has the molecular formula C22H14F2 and a molecular weight of 316.35 g/mol. Its IUPAC name is 1,8-bis(4-fluorophenyl)naphthalene.

Molecular Properties

Compound Name1,8-bis(4-fluorophenyl)naphthalene
PubChem CID123918209
Molecular FormulaC22H14F2
Molecular Weight316.35 g/mol
Exact Mass316.11
IUPAC Name1,8-bis(4-fluorophenyl)naphthalene
SMILESFc1ccc(-c2cccc3cccc(-c4ccc(F)cc4)c23)cc1
InChIInChI=1S/C22H14F2/c23-18-11-7-15(8-12-18)20-5-1-3-17-4-2-6-21(22(17)20)16-9-13-19(24)14-10-16/h1-14H
InChIKeyXCURNERJZKSOLU-UHFFFAOYSA-N
XLogP6.45
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500316.35
LogP ≤ 56.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 1,8-bis(4-fluorophenyl)naphthalene 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 1,8-bis(4-fluorophenyl)naphthalene?
The IUPAC name of 1,8-bis(4-fluorophenyl)naphthalene (CID 123918209) is 1,8-bis(4-fluorophenyl)naphthalene.
What is the SMILES notation for 1,8-bis(4-fluorophenyl)naphthalene?
The canonical SMILES for 1,8-bis(4-fluorophenyl)naphthalene is Fc1ccc(-c2cccc3cccc(-c4ccc(F)cc4)c23)cc1.
What is the InChIKey of 1,8-bis(4-fluorophenyl)naphthalene?
The InChIKey is XCURNERJZKSOLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H14F2/c23-18-11-7-15(8-12-18)20-5-1-3-17-4-2-6-21(22(17)20)16-9-13-19(24)14-10-16/h1-14H.
What are the key properties of 1,8-bis(4-fluorophenyl)naphthalene?
1,8-bis(4-fluorophenyl)naphthalene has a molecular weight of 316.35 g/mol, XLogP of 6.45, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,8-bis(4-fluorophenyl)naphthalene is sourced from PubChem (CID 123918209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).