[2-(2-fluoroethyl)cyclohexyl]methanol

C9H17FO — CID 84716751

IUPAC[2-(2-fluoroethyl)cyclohexyl]methanol
SMILESOCC1CCCCC1CCF
InChIInChI=1S/C9H17FO/c10-6-5-8-3-1-2-4-9(8)7-11/h8-9,11H,1-7H2
InChIKeyHREMAWPVFOKWCL-UHFFFAOYSA-N
MW160.23 g/mol
LogP2.14
Rot. Bonds3

About [2-(2-fluoroethyl)cyclohexyl]methanol

[2-(2-fluoroethyl)cyclohexyl]methanol (PubChem CID 84716751) has the molecular formula C9H17FO and a molecular weight of 160.23 g/mol. Its IUPAC name is [2-(2-fluoroethyl)cyclohexyl]methanol.

Molecular Properties

Compound Name[2-(2-fluoroethyl)cyclohexyl]methanol
PubChem CID84716751
Molecular FormulaC9H17FO
Molecular Weight160.23 g/mol
Exact Mass160.13
IUPAC Name[2-(2-fluoroethyl)cyclohexyl]methanol
SMILESOCC1CCCCC1CCF
InChIInChI=1S/C9H17FO/c10-6-5-8-3-1-2-4-9(8)7-11/h8-9,11H,1-7H2
InChIKeyHREMAWPVFOKWCL-UHFFFAOYSA-N
XLogP2.14
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.23
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of [2-(2-fluoroethyl)cyclohexyl]methanol?
The IUPAC name of [2-(2-fluoroethyl)cyclohexyl]methanol (CID 84716751) is [2-(2-fluoroethyl)cyclohexyl]methanol.
What is the SMILES notation for [2-(2-fluoroethyl)cyclohexyl]methanol?
The canonical SMILES for [2-(2-fluoroethyl)cyclohexyl]methanol is OCC1CCCCC1CCF.
What is the InChIKey of [2-(2-fluoroethyl)cyclohexyl]methanol?
The InChIKey is HREMAWPVFOKWCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17FO/c10-6-5-8-3-1-2-4-9(8)7-11/h8-9,11H,1-7H2.
What are the key properties of [2-(2-fluoroethyl)cyclohexyl]methanol?
[2-(2-fluoroethyl)cyclohexyl]methanol has a molecular weight of 160.23 g/mol, XLogP of 2.14, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-fluoroethyl)cyclohexyl]methanol is sourced from PubChem (CID 84716751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).