1-fluoro-4-[2-(4-fluorophenyl)ethyl]benzene

C14H12F2 — CID 573306

IUPAC1-fluoro-4-[2-(4-fluorophenyl)ethyl]benzene
SMILESFc1ccc(CCc2ccc(F)cc2)cc1
InChIInChI=1S/C14H12F2/c15-13-7-3-11(4-8-13)1-2-12-5-9-14(16)10-6-12/h3-10H,1-2H2
InChIKeyPYRSXVQXDHTFMW-UHFFFAOYSA-N
MW218.25 g/mol
LogP3.75
Rot. Bonds3

About 1-fluoro-4-[2-(4-fluorophenyl)ethyl]benzene

1-fluoro-4-[2-(4-fluorophenyl)ethyl]benzene (PubChem CID 573306) has the molecular formula C14H12F2 and a molecular weight of 218.25 g/mol. Its IUPAC name is 1-fluoro-4-[2-(4-fluorophenyl)ethyl]benzene.

Molecular Properties

Compound Name1-fluoro-4-[2-(4-fluorophenyl)ethyl]benzene
PubChem CID573306
Molecular FormulaC14H12F2
Molecular Weight218.25 g/mol
Exact Mass218.09
IUPAC Name1-fluoro-4-[2-(4-fluorophenyl)ethyl]benzene
SMILESFc1ccc(CCc2ccc(F)cc2)cc1
InChIInChI=1S/C14H12F2/c15-13-7-3-11(4-8-13)1-2-12-5-9-14(16)10-6-12/h3-10H,1-2H2
InChIKeyPYRSXVQXDHTFMW-UHFFFAOYSA-N
XLogP3.75
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.25
LogP ≤ 53.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 1-fluoro-4-[2-(4-fluorophenyl)ethyl]benzene 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-fluoro-4-[2-(4-fluorophenyl)ethyl]benzene?
The IUPAC name of 1-fluoro-4-[2-(4-fluorophenyl)ethyl]benzene (CID 573306) is 1-fluoro-4-[2-(4-fluorophenyl)ethyl]benzene.
What is the SMILES notation for 1-fluoro-4-[2-(4-fluorophenyl)ethyl]benzene?
The canonical SMILES for 1-fluoro-4-[2-(4-fluorophenyl)ethyl]benzene is Fc1ccc(CCc2ccc(F)cc2)cc1.
What is the InChIKey of 1-fluoro-4-[2-(4-fluorophenyl)ethyl]benzene?
The InChIKey is PYRSXVQXDHTFMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12F2/c15-13-7-3-11(4-8-13)1-2-12-5-9-14(16)10-6-12/h3-10H,1-2H2.
What are the key properties of 1-fluoro-4-[2-(4-fluorophenyl)ethyl]benzene?
1-fluoro-4-[2-(4-fluorophenyl)ethyl]benzene has a molecular weight of 218.25 g/mol, XLogP of 3.75, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-fluoro-4-[2-(4-fluorophenyl)ethyl]benzene is sourced from PubChem (CID 573306), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).