(4-fluoro-4-methylcyclohexyl)methanol

C8H15FO — CID 84649094

IUPAC(4-fluoro-4-methylcyclohexyl)methanol
SMILESCC1(F)CCC(CO)CC1
InChIInChI=1S/C8H15FO/c1-8(9)4-2-7(6-10)3-5-8/h7,10H,2-6H2,1H3
InChIKeyDGLNQIPHOPNBLI-UHFFFAOYSA-N
MW146.21 g/mol
LogP1.90
Rot. Bonds1

About (4-fluoro-4-methylcyclohexyl)methanol

(4-fluoro-4-methylcyclohexyl)methanol (PubChem CID 84649094) has the molecular formula C8H15FO and a molecular weight of 146.21 g/mol. Its IUPAC name is (4-fluoro-4-methylcyclohexyl)methanol.

Molecular Properties

Compound Name(4-fluoro-4-methylcyclohexyl)methanol
PubChem CID84649094
Molecular FormulaC8H15FO
Molecular Weight146.21 g/mol
Exact Mass146.11
IUPAC Name(4-fluoro-4-methylcyclohexyl)methanol
SMILESCC1(F)CCC(CO)CC1
InChIInChI=1S/C8H15FO/c1-8(9)4-2-7(6-10)3-5-8/h7,10H,2-6H2,1H3
InChIKeyDGLNQIPHOPNBLI-UHFFFAOYSA-N
XLogP1.90
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.21
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (4-fluoro-4-methylcyclohexyl)methanol?
The IUPAC name of (4-fluoro-4-methylcyclohexyl)methanol (CID 84649094) is (4-fluoro-4-methylcyclohexyl)methanol.
What is the SMILES notation for (4-fluoro-4-methylcyclohexyl)methanol?
The canonical SMILES for (4-fluoro-4-methylcyclohexyl)methanol is CC1(F)CCC(CO)CC1.
What is the InChIKey of (4-fluoro-4-methylcyclohexyl)methanol?
The InChIKey is DGLNQIPHOPNBLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15FO/c1-8(9)4-2-7(6-10)3-5-8/h7,10H,2-6H2,1H3.
What are the key properties of (4-fluoro-4-methylcyclohexyl)methanol?
(4-fluoro-4-methylcyclohexyl)methanol has a molecular weight of 146.21 g/mol, XLogP of 1.90, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4-fluoro-4-methylcyclohexyl)methanol is sourced from PubChem (CID 84649094), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).