(2R)-1-ethoxy-2-fluorocyclododecane

C14H27FO — CID 177416106

IUPAC(2R)-1-ethoxy-2-fluorocyclododecane
SMILESCCOC1CCCCCCCCCC[C@H]1F
InChIInChI=1S/C14H27FO/c1-2-16-14-12-10-8-6-4-3-5-7-9-11-13(14)15/h13-14H,2-12H2,1H3/t13-,14?/m1/s1
InChIKeyOVIHETANRVTYSB-KWCCSABGSA-N
MW230.37 g/mol
LogP4.64
Rot. Bonds2

About (2R)-1-ethoxy-2-fluorocyclododecane

(2R)-1-ethoxy-2-fluorocyclododecane (PubChem CID 177416106) has the molecular formula C14H27FO and a molecular weight of 230.37 g/mol. Its IUPAC name is (2R)-1-ethoxy-2-fluorocyclododecane.

Molecular Properties

Compound Name(2R)-1-ethoxy-2-fluorocyclododecane
PubChem CID177416106
Molecular FormulaC14H27FO
Molecular Weight230.37 g/mol
Exact Mass230.20
IUPAC Name(2R)-1-ethoxy-2-fluorocyclododecane
SMILESCCOC1CCCCCCCCCC[C@H]1F
InChIInChI=1S/C14H27FO/c1-2-16-14-12-10-8-6-4-3-5-7-9-11-13(14)15/h13-14H,2-12H2,1H3/t13-,14?/m1/s1
InChIKeyOVIHETANRVTYSB-KWCCSABGSA-N
XLogP4.64
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.37
LogP ≤ 54.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

trans-(1R,2R)-1,2-diethoxycyclohexane
CID 13170081
2-ethoxycyclooctan-1-ol
CID 18953000
cis-(1S,2R)-1-fluoro-2-methoxycyclohexane
CID 12700790
ethyl (2-fluorocyclohexyl) sulfite
CID 87155107
carbanide;bis(dimethylazanide);(2-fluorocyclopentyl)oxymethyl-methylazanide;hafnium(4+)
CID 171766570
ethoxycyclooctane
CID 13427982
[(1S,2S)-2-fluorocyclohexyl] acetate
CID 45090703
trans-(1S,2R)-1-ethoxy-2-propylcyclohexane
CID 94034878
[(1R,2R)-2-ethoxycyclohexyl]-trimethylsilane
CID 91703112
azane;ethoxycyclooctane
CID 70271275
[(1R,2S)-2-ethoxycyclohexyl]hydrazine
CID 124537767
2-ethoxycyclopentan-1-amine
CID 16792821

Frequently Asked Questions

What is the IUPAC name of (2R)-1-ethoxy-2-fluorocyclododecane?
The IUPAC name of (2R)-1-ethoxy-2-fluorocyclododecane (CID 177416106) is (2R)-1-ethoxy-2-fluorocyclododecane.
What is the SMILES notation for (2R)-1-ethoxy-2-fluorocyclododecane?
The canonical SMILES for (2R)-1-ethoxy-2-fluorocyclododecane is CCOC1CCCCCCCCCC[C@H]1F.
What is the InChIKey of (2R)-1-ethoxy-2-fluorocyclododecane?
The InChIKey is OVIHETANRVTYSB-KWCCSABGSA-N. The full InChI is InChI=1S/C14H27FO/c1-2-16-14-12-10-8-6-4-3-5-7-9-11-13(14)15/h13-14H,2-12H2,1H3/t13-,14?/m1/s1.
What are the key properties of (2R)-1-ethoxy-2-fluorocyclododecane?
(2R)-1-ethoxy-2-fluorocyclododecane has a molecular weight of 230.37 g/mol, XLogP of 4.64, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-ethoxy-2-fluorocyclododecane is sourced from PubChem (CID 177416106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).