1-fluoro-4-[4-(4-fluorophenyl)cyclohexyl]benzene

C18H18F2 — CID 122631633

IUPAC1-fluoro-4-[4-(4-fluorophenyl)cyclohexyl]benzene
SMILESFc1ccc(C2CCC(c3ccc(F)cc3)CC2)cc1
InChIInChI=1S/C18H18F2/c19-17-9-5-15(6-10-17)13-1-2-14(4-3-13)16-7-11-18(20)12-8-16/h5-14H,1-4H2
InChIKeyFKFIDHOQGJOOLU-UHFFFAOYSA-N
MW272.34 g/mol
LogP5.41
Rot. Bonds2

About 1-fluoro-4-[4-(4-fluorophenyl)cyclohexyl]benzene

1-fluoro-4-[4-(4-fluorophenyl)cyclohexyl]benzene (PubChem CID 122631633) has the molecular formula C18H18F2 and a molecular weight of 272.34 g/mol. Its IUPAC name is 1-fluoro-4-[4-(4-fluorophenyl)cyclohexyl]benzene.

Molecular Properties

Compound Name1-fluoro-4-[4-(4-fluorophenyl)cyclohexyl]benzene
PubChem CID122631633
Molecular FormulaC18H18F2
Molecular Weight272.34 g/mol
Exact Mass272.14
IUPAC Name1-fluoro-4-[4-(4-fluorophenyl)cyclohexyl]benzene
SMILESFc1ccc(C2CCC(c3ccc(F)cc3)CC2)cc1
InChIInChI=1S/C18H18F2/c19-17-9-5-15(6-10-17)13-1-2-14(4-3-13)16-7-11-18(20)12-8-16/h5-14H,1-4H2
InChIKeyFKFIDHOQGJOOLU-UHFFFAOYSA-N
XLogP5.41
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500272.34
LogP ≤ 55.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1-fluoro-4-(4-fluorocyclohexyl)benzene
CID 23539867
1-fluoro-4-(4-methylcyclohexyl)benzene;molecular hydrogen
CID 158127728
1-[4-(bromomethyl)cyclohexyl]-4-fluorobenzene
CID 177244995
1-(4-cyclopropylphenyl)-N-[(4-fluorophenyl)methyl]methanamine
CID 79979256
ethane;4-(4-fluorophenyl)piperidine
CID 144692128
2-[4-(4-cyclopropylphenyl)phenyl]-6-[4-(4-fluorophenyl)phenyl]naphthalene
CID 170293668
1-[4-(4-fluorophenyl)cyclohexyl]ethanone
CID 15047101
1-(3-chlorocyclopentyl)-4-fluorobenzene
CID 64515664
CID 22404112
CID 22404112
trans-(1R,3R)-3-(4-fluorophenyl)cyclopentan-1-amine
CID 94827218
CID 22902624
CID 22902624
1-fluoro-4-[4-(4-methylcyclohexyl)cyclohexyl]benzene;methane;molecular hydrogen
CID 160545349

Frequently Asked Questions

What is the IUPAC name of 1-fluoro-4-[4-(4-fluorophenyl)cyclohexyl]benzene?
The IUPAC name of 1-fluoro-4-[4-(4-fluorophenyl)cyclohexyl]benzene (CID 122631633) is 1-fluoro-4-[4-(4-fluorophenyl)cyclohexyl]benzene.
What is the SMILES notation for 1-fluoro-4-[4-(4-fluorophenyl)cyclohexyl]benzene?
The canonical SMILES for 1-fluoro-4-[4-(4-fluorophenyl)cyclohexyl]benzene is Fc1ccc(C2CCC(c3ccc(F)cc3)CC2)cc1.
What is the InChIKey of 1-fluoro-4-[4-(4-fluorophenyl)cyclohexyl]benzene?
The InChIKey is FKFIDHOQGJOOLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18F2/c19-17-9-5-15(6-10-17)13-1-2-14(4-3-13)16-7-11-18(20)12-8-16/h5-14H,1-4H2.
What are the key properties of 1-fluoro-4-[4-(4-fluorophenyl)cyclohexyl]benzene?
1-fluoro-4-[4-(4-fluorophenyl)cyclohexyl]benzene has a molecular weight of 272.34 g/mol, XLogP of 5.41, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-fluoro-4-[4-(4-fluorophenyl)cyclohexyl]benzene is sourced from PubChem (CID 122631633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).