1-fluoro-4-(4-fluorocyclohexyl)benzene

C12H14F2 — CID 23539867

IUPAC1-fluoro-4-(4-fluorocyclohexyl)benzene
SMILESFc1ccc(C2CCC(F)CC2)cc1
InChIInChI=1S/C12H14F2/c13-11-5-1-9(2-6-11)10-3-7-12(14)8-4-10/h1-2,5-6,10,12H,3-4,7-8H2
InChIKeyNZBYHMUQGFWZEL-UHFFFAOYSA-N
MW196.24 g/mol
LogP3.82
Rot. Bonds1

About 1-fluoro-4-(4-fluorocyclohexyl)benzene

1-fluoro-4-(4-fluorocyclohexyl)benzene (PubChem CID 23539867) has the molecular formula C12H14F2 and a molecular weight of 196.24 g/mol. Its IUPAC name is 1-fluoro-4-(4-fluorocyclohexyl)benzene.

Molecular Properties

Compound Name1-fluoro-4-(4-fluorocyclohexyl)benzene
PubChem CID23539867
Molecular FormulaC12H14F2
Molecular Weight196.24 g/mol
Exact Mass196.11
IUPAC Name1-fluoro-4-(4-fluorocyclohexyl)benzene
SMILESFc1ccc(C2CCC(F)CC2)cc1
InChIInChI=1S/C12H14F2/c13-11-5-1-9(2-6-11)10-3-7-12(14)8-4-10/h1-2,5-6,10,12H,3-4,7-8H2
InChIKeyNZBYHMUQGFWZEL-UHFFFAOYSA-N
XLogP3.82
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.24
LogP ≤ 53.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1-fluoro-4-[4-(4-fluorophenyl)cyclohexyl]benzene
CID 122631633
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
[4-(4-fluorocyclohexyl)phenyl]boronic acid
CID 141461374
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-(4-fluorocyclohexyl)-4-(trifluoromethoxy)benzene
CID 23539864
1-(3-chlorocyclopentyl)-4-fluorobenzene
CID 64515664
CID 22404112
CID 22404112
trans-(1R,3R)-3-(4-fluorophenyl)cyclopentan-1-amine
CID 94827218

Frequently Asked Questions

What is the IUPAC name of 1-fluoro-4-(4-fluorocyclohexyl)benzene?
The IUPAC name of 1-fluoro-4-(4-fluorocyclohexyl)benzene (CID 23539867) is 1-fluoro-4-(4-fluorocyclohexyl)benzene.
What is the SMILES notation for 1-fluoro-4-(4-fluorocyclohexyl)benzene?
The canonical SMILES for 1-fluoro-4-(4-fluorocyclohexyl)benzene is Fc1ccc(C2CCC(F)CC2)cc1.
What is the InChIKey of 1-fluoro-4-(4-fluorocyclohexyl)benzene?
The InChIKey is NZBYHMUQGFWZEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14F2/c13-11-5-1-9(2-6-11)10-3-7-12(14)8-4-10/h1-2,5-6,10,12H,3-4,7-8H2.
What are the key properties of 1-fluoro-4-(4-fluorocyclohexyl)benzene?
1-fluoro-4-(4-fluorocyclohexyl)benzene has a molecular weight of 196.24 g/mol, XLogP of 3.82, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-fluoro-4-(4-fluorocyclohexyl)benzene is sourced from PubChem (CID 23539867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).