1-(3-fluorophenyl)cyclohexan-1-ol

C12H15FO — CID 2802229

IUPAC1-(3-fluorophenyl)cyclohexan-1-ol
SMILESOC1(c2cccc(F)c2)CCCCC1
InChIInChI=1S/C12H15FO/c13-11-6-4-5-10(9-11)12(14)7-2-1-3-8-12/h4-6,9,14H,1-3,7-8H2
InChIKeyPQSFDHKUPBPVLK-UHFFFAOYSA-N
MW194.25 g/mol
LogP2.98
Rot. Bonds1

About 1-(3-fluorophenyl)cyclohexan-1-ol

1-(3-fluorophenyl)cyclohexan-1-ol (PubChem CID 2802229) has the molecular formula C12H15FO and a molecular weight of 194.25 g/mol. Its IUPAC name is 1-(3-fluorophenyl)cyclohexan-1-ol.

Molecular Properties

Compound Name1-(3-fluorophenyl)cyclohexan-1-ol
PubChem CID2802229
Molecular FormulaC12H15FO
Molecular Weight194.25 g/mol
Exact Mass194.11
IUPAC Name1-(3-fluorophenyl)cyclohexan-1-ol
SMILESOC1(c2cccc(F)c2)CCCCC1
InChIInChI=1S/C12H15FO/c13-11-6-4-5-10(9-11)12(14)7-2-1-3-8-12/h4-6,9,14H,1-3,7-8H2
InChIKeyPQSFDHKUPBPVLK-UHFFFAOYSA-N
XLogP2.98
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.25
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-(3-fluorophenyl)cyclohexan-1-ol?
The IUPAC name of 1-(3-fluorophenyl)cyclohexan-1-ol (CID 2802229) is 1-(3-fluorophenyl)cyclohexan-1-ol.
What is the SMILES notation for 1-(3-fluorophenyl)cyclohexan-1-ol?
The canonical SMILES for 1-(3-fluorophenyl)cyclohexan-1-ol is OC1(c2cccc(F)c2)CCCCC1.
What is the InChIKey of 1-(3-fluorophenyl)cyclohexan-1-ol?
The InChIKey is PQSFDHKUPBPVLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15FO/c13-11-6-4-5-10(9-11)12(14)7-2-1-3-8-12/h4-6,9,14H,1-3,7-8H2.
What are the key properties of 1-(3-fluorophenyl)cyclohexan-1-ol?
1-(3-fluorophenyl)cyclohexan-1-ol has a molecular weight of 194.25 g/mol, XLogP of 2.98, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-fluorophenyl)cyclohexan-1-ol is sourced from PubChem (CID 2802229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).