4-fluoro-1-oxaspiro[5.6]dodecane

C11H19FO — CID 25208212

IUPAC4-fluoro-1-oxaspiro[5.6]dodecane
SMILESFC1CCOC2(CCCCCC2)C1
InChIInChI=1S/C11H19FO/c12-10-5-8-13-11(9-10)6-3-1-2-4-7-11/h10H,1-9H2
InChIKeyFMRKPXUHJIYFPL-UHFFFAOYSA-N
MW186.27 g/mol
LogP3.23
Rot. Bonds

About 4-fluoro-1-oxaspiro[5.6]dodecane

4-fluoro-1-oxaspiro[5.6]dodecane (PubChem CID 25208212) has the molecular formula C11H19FO and a molecular weight of 186.27 g/mol. Its IUPAC name is 4-fluoro-1-oxaspiro[5.6]dodecane.

Molecular Properties

Compound Name4-fluoro-1-oxaspiro[5.6]dodecane
PubChem CID25208212
Molecular FormulaC11H19FO
Molecular Weight186.27 g/mol
Exact Mass186.14
IUPAC Name4-fluoro-1-oxaspiro[5.6]dodecane
SMILESFC1CCOC2(CCCCCC2)C1
InChIInChI=1S/C11H19FO/c12-10-5-8-13-11(9-10)6-3-1-2-4-7-11/h10H,1-9H2
InChIKeyFMRKPXUHJIYFPL-UHFFFAOYSA-N
XLogP3.23
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.27
LogP ≤ 53.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

9-Fluoro-6-oxaspiro[4.5]decane
CID 25208211
4-Fluoro-1-oxaspiro[5.5]undecane
CID 102032176
4-Fluoro-1-oxaspiro[5.11]heptadecane
CID 154713512
1-Oxaspiro(5.6)dodecane
CID 96632218
2,2-Bis(4,4-difluorobutyl)oxane
CID 57090603
(2S,3S)-2-ethyl-3-fluoro-2,4-dimethyloxane
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1-Ethyl-4-fluoro-1-methoxy-4-methylcycloheptane
CID 174248083
(2S,3R)-3-fluoro-3-methyl-2-octyloxane
CID 11183835
(7R)-7-fluoro-5-oxaspiro[3.5]nonane
CID 159499413
(7S)-7-fluoro-5-oxaspiro[3.5]nonane
CID 159499415
8-Fluoro-5-oxaspiro[3.5]nonane
CID 159917774
2-Butyl-2-methyloxane
CID 13494550

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-1-oxaspiro[5.6]dodecane?
The IUPAC name of 4-fluoro-1-oxaspiro[5.6]dodecane (CID 25208212) is 4-fluoro-1-oxaspiro[5.6]dodecane.
What is the SMILES notation for 4-fluoro-1-oxaspiro[5.6]dodecane?
The canonical SMILES for 4-fluoro-1-oxaspiro[5.6]dodecane is FC1CCOC2(CCCCCC2)C1.
What is the InChIKey of 4-fluoro-1-oxaspiro[5.6]dodecane?
The InChIKey is FMRKPXUHJIYFPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19FO/c12-10-5-8-13-11(9-10)6-3-1-2-4-7-11/h10H,1-9H2.
What are the key properties of 4-fluoro-1-oxaspiro[5.6]dodecane?
4-fluoro-1-oxaspiro[5.6]dodecane has a molecular weight of 186.27 g/mol, XLogP of 3.23, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-1-oxaspiro[5.6]dodecane is sourced from PubChem (CID 25208212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).