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

C11H16F6O — CID 18725566

IUPAC(1-ethoxy-1,1,2,3,3,3-hexafluoropropan-2-yl)cyclohexane
SMILESCCOC(F)(F)C(F)(C1CCCCC1)C(F)(F)F
InChIInChI=1S/C11H16F6O/c1-2-18-11(16,17)9(12,10(13,14)15)8-6-4-3-5-7-8/h8H,2-7H2,1H3
InChIKeyRABIWKULSGNWHQ-UHFFFAOYSA-N
MW278.24 g/mol
LogP4.47
Rot. Bonds4

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

(1-ethoxy-1,1,2,3,3,3-hexafluoropropan-2-yl)cyclohexane (PubChem CID 18725566) has the molecular formula C11H16F6O and a molecular weight of 278.24 g/mol. Its IUPAC name is (1-ethoxy-1,1,2,3,3,3-hexafluoropropan-2-yl)cyclohexane.

Molecular Properties

Compound Name(1-ethoxy-1,1,2,3,3,3-hexafluoropropan-2-yl)cyclohexane
PubChem CID18725566
Molecular FormulaC11H16F6O
Molecular Weight278.24 g/mol
Exact Mass278.11
IUPAC Name(1-ethoxy-1,1,2,3,3,3-hexafluoropropan-2-yl)cyclohexane
SMILESCCOC(F)(F)C(F)(C1CCCCC1)C(F)(F)F
InChIInChI=1S/C11H16F6O/c1-2-18-11(16,17)9(12,10(13,14)15)8-6-4-3-5-7-8/h8H,2-7H2,1H3
InChIKeyRABIWKULSGNWHQ-UHFFFAOYSA-N
XLogP4.47
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
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

1-[Ethoxy(difluoro)methyl]-4-methylcyclohexane
CID 11805558
2,2,2-Trifluoroethoxymethylcyclohexane
CID 14970149
3-(5-Ethoxy-2,2,3,3-tetrafluoropentyl)-4-methyloxolane
CID 11778000
3-(2,2,3,3,4,4,5,5,6,6,7,7-Dodecafluoroheptyl)-4-methyloxolane
CID 85267668
3-Methyl-4-(2,2,3,3,4,4,5,5,6,6,7,7,7-tridecafluoroheptyl)oxolane
CID 101115659
3-Methyl-4-(2,2,3,3,4,4,5,5-octafluoropentyl)oxolane
CID 101115660
3-(2,2,2-Trifluoroethoxy)propylcyclohexane
CID 121221077
1,1,2,3,3-Pentafluoro-2-(2-methoxyethyl)cyclohexane
CID 18684088
1-[Difluoro(methoxy)methyl]-3-(fluoromethyl)-5-methylcyclohexane
CID 18725562
1-[Difluoro(methoxy)methyl]-3-methylcyclohexane
CID 18725563
(3-Ethoxy-1,1,2,2,3,3-hexafluoropropyl)cyclohexane
CID 18725571
[Ethoxy(difluoro)methyl]cyclohexane
CID 18725579

Frequently Asked Questions

What is the IUPAC name of (1-ethoxy-1,1,2,3,3,3-hexafluoropropan-2-yl)cyclohexane?
The IUPAC name of (1-ethoxy-1,1,2,3,3,3-hexafluoropropan-2-yl)cyclohexane (CID 18725566) is (1-ethoxy-1,1,2,3,3,3-hexafluoropropan-2-yl)cyclohexane.
What is the SMILES notation for (1-ethoxy-1,1,2,3,3,3-hexafluoropropan-2-yl)cyclohexane?
The canonical SMILES for (1-ethoxy-1,1,2,3,3,3-hexafluoropropan-2-yl)cyclohexane is CCOC(F)(F)C(F)(C1CCCCC1)C(F)(F)F.
What is the InChIKey of (1-ethoxy-1,1,2,3,3,3-hexafluoropropan-2-yl)cyclohexane?
The InChIKey is RABIWKULSGNWHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16F6O/c1-2-18-11(16,17)9(12,10(13,14)15)8-6-4-3-5-7-8/h8H,2-7H2,1H3.
What are the key properties of (1-ethoxy-1,1,2,3,3,3-hexafluoropropan-2-yl)cyclohexane?
(1-ethoxy-1,1,2,3,3,3-hexafluoropropan-2-yl)cyclohexane has a molecular weight of 278.24 g/mol, XLogP of 4.47, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1-ethoxy-1,1,2,3,3,3-hexafluoropropan-2-yl)cyclohexane is sourced from PubChem (CID 18725566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).