(2-ethoxy-1,1,1,3,3,3-hexafluoropropan-2-yl)cyclohexane

C11H16F6O — CID 89363105

IUPAC(2-ethoxy-1,1,1,3,3,3-hexafluoropropan-2-yl)cyclohexane
SMILESCCOC(C1CCCCC1)(C(F)(F)F)C(F)(F)F
InChIInChI=1S/C11H16F6O/c1-2-18-9(10(12,13)14,11(15,16)17)8-6-4-3-5-7-8/h8H,2-7H2,1H3
InChIKeyJICIDWBBWSXYGJ-UHFFFAOYSA-N
MW278.24 g/mol
LogP4.47
Rot. Bonds3

About (2-ethoxy-1,1,1,3,3,3-hexafluoropropan-2-yl)cyclohexane

(2-ethoxy-1,1,1,3,3,3-hexafluoropropan-2-yl)cyclohexane (PubChem CID 89363105) has the molecular formula C11H16F6O and a molecular weight of 278.24 g/mol. Its IUPAC name is (2-ethoxy-1,1,1,3,3,3-hexafluoropropan-2-yl)cyclohexane.

Molecular Properties

Compound Name(2-ethoxy-1,1,1,3,3,3-hexafluoropropan-2-yl)cyclohexane
PubChem CID89363105
Molecular FormulaC11H16F6O
Molecular Weight278.24 g/mol
Exact Mass278.11
IUPAC Name(2-ethoxy-1,1,1,3,3,3-hexafluoropropan-2-yl)cyclohexane
SMILESCCOC(C1CCCCC1)(C(F)(F)F)C(F)(F)F
InChIInChI=1S/C11H16F6O/c1-2-18-9(10(12,13)14,11(15,16)17)8-6-4-3-5-7-8/h8H,2-7H2,1H3
InChIKeyJICIDWBBWSXYGJ-UHFFFAOYSA-N
XLogP4.47
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.24
LogP ≤ 54.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

Cyclohexane, (1-ethoxy-1-methylethyl)-
CID 175128
(6S)-2,6-dimethyl-6-(2,2,2-trifluoroethoxy)octane
CID 10752552
3-(2,2,2-Trifluoroethoxy)propylcyclohexane
CID 121221077
(1-Ethoxy-1,1,2,3,3,3-hexafluoropropan-2-yl)cyclohexane
CID 18725566
(3-Ethoxy-1,1,2,2,3,3-hexafluoropropyl)cyclohexane
CID 18725571
[Ethoxy(difluoro)methyl]cyclohexane
CID 18725579
1-[Ethoxy(difluoro)methyl]-3-methylcyclohexane
CID 18731748
1-Fluoro-1-(2-methoxypropan-2-yl)cyclohexane
CID 19850337
1-(1,1-Difluoroethyl)-1,2,2-trifluoro-5-methyl-3-octoxy-3-(trifluoromethyl)cyclohexane
CID 20781747
1-Methyl-4-[4-(1,2,2,2-tetrafluoroethoxy)cyclohexyl]cyclohexane
CID 20802022
1-[Difluoro(propoxy)methyl]-4-fluorocyclohexane
CID 21052142
Pentafluoroethyl[(4'alpha-propyl-1alpha,1'beta-bi[cyclohexane]-4beta-yl)methyl] ether
CID 22506272

Frequently Asked Questions

What is the IUPAC name of (2-ethoxy-1,1,1,3,3,3-hexafluoropropan-2-yl)cyclohexane?
The IUPAC name of (2-ethoxy-1,1,1,3,3,3-hexafluoropropan-2-yl)cyclohexane (CID 89363105) is (2-ethoxy-1,1,1,3,3,3-hexafluoropropan-2-yl)cyclohexane.
What is the SMILES notation for (2-ethoxy-1,1,1,3,3,3-hexafluoropropan-2-yl)cyclohexane?
The canonical SMILES for (2-ethoxy-1,1,1,3,3,3-hexafluoropropan-2-yl)cyclohexane is CCOC(C1CCCCC1)(C(F)(F)F)C(F)(F)F.
What is the InChIKey of (2-ethoxy-1,1,1,3,3,3-hexafluoropropan-2-yl)cyclohexane?
The InChIKey is JICIDWBBWSXYGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16F6O/c1-2-18-9(10(12,13)14,11(15,16)17)8-6-4-3-5-7-8/h8H,2-7H2,1H3.
What are the key properties of (2-ethoxy-1,1,1,3,3,3-hexafluoropropan-2-yl)cyclohexane?
(2-ethoxy-1,1,1,3,3,3-hexafluoropropan-2-yl)cyclohexane has a molecular weight of 278.24 g/mol, XLogP of 4.47, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2-ethoxy-1,1,1,3,3,3-hexafluoropropan-2-yl)cyclohexane is sourced from PubChem (CID 89363105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).