2-cyclohexyl-4-fluorooxolane

C10H17FO — CID 12038085

IUPAC2-cyclohexyl-4-fluorooxolane
SMILESFC1COC(C2CCCCC2)C1
InChIInChI=1S/C10H17FO/c11-9-6-10(12-7-9)8-4-2-1-3-5-8/h8-10H,1-7H2
InChIKeyJRDCRRXZGUYDCM-UHFFFAOYSA-N
MW172.24 g/mol
LogP2.69
Rot. Bonds1

About 2-cyclohexyl-4-fluorooxolane

2-cyclohexyl-4-fluorooxolane (PubChem CID 12038085) has the molecular formula C10H17FO and a molecular weight of 172.24 g/mol. Its IUPAC name is 2-cyclohexyl-4-fluorooxolane.

Molecular Properties

Compound Name2-cyclohexyl-4-fluorooxolane
PubChem CID12038085
Molecular FormulaC10H17FO
Molecular Weight172.24 g/mol
Exact Mass172.13
IUPAC Name2-cyclohexyl-4-fluorooxolane
SMILESFC1COC(C2CCCCC2)C1
InChIInChI=1S/C10H17FO/c11-9-6-10(12-7-9)8-4-2-1-3-5-8/h8-10H,1-7H2
InChIKeyJRDCRRXZGUYDCM-UHFFFAOYSA-N
XLogP2.69
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.24
LogP ≤ 52.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

Tetradecahydrocyclododeca[b]furan
CID 14687820
1-Oxaspiro(4.5)decane
CID 301168
(2R,4S)-2-cyclohexyl-4-fluorooxane
CID 146168810
(3aR,5R,7aS)-5-fluoro-2,3,3a,4,5,6,7,7a-octahydro-1-benzofuran
CID 167065217
2-(Cyclohexylmethyl)oxolane
CID 14027486
Cyclohexyltetrahydrofuran
CID 69429853
(2S,4R)-2-cyclohexyl-4-fluorooxane
CID 11745349
3-Fluoro-1-oxaspiro[4.5]decane
CID 12038086
(2R,3aR,5R,7aS)-5-fluoro-2-methyl-2,3,3a,4,5,6,7,7a-octahydro-1-benzofuran
CID 177853573
(2R,3aS,7S,7aR)-7-fluoro-2-methyl-2,3,3a,4,5,6,7,7a-octahydro-1-benzofuran
CID 177853575
2-(Cyclohexylmethyl)oxetane
CID 162409394
Oxabicyclopentane
CID 21071687

Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-4-fluorooxolane?
The IUPAC name of 2-cyclohexyl-4-fluorooxolane (CID 12038085) is 2-cyclohexyl-4-fluorooxolane.
What is the SMILES notation for 2-cyclohexyl-4-fluorooxolane?
The canonical SMILES for 2-cyclohexyl-4-fluorooxolane is FC1COC(C2CCCCC2)C1.
What is the InChIKey of 2-cyclohexyl-4-fluorooxolane?
The InChIKey is JRDCRRXZGUYDCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17FO/c11-9-6-10(12-7-9)8-4-2-1-3-5-8/h8-10H,1-7H2.
What are the key properties of 2-cyclohexyl-4-fluorooxolane?
2-cyclohexyl-4-fluorooxolane has a molecular weight of 172.24 g/mol, XLogP of 2.69, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-4-fluorooxolane is sourced from PubChem (CID 12038085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).