2,2,2-trifluoro-1-[4-(2,2,2-trifluoro-1-hydroxyethyl)cyclohexyl]ethanol

C10H14F6O2 — CID 59850747

IUPAC2,2,2-trifluoro-1-[4-(2,2,2-trifluoro-1-hydroxyethyl)cyclohexyl]ethanol
SMILESOC(C1CCC(C(O)C(F)(F)F)CC1)C(F)(F)F
InChIInChI=1S/C10H14F6O2/c11-9(12,13)7(17)5-1-2-6(4-3-5)8(18)10(14,15)16/h5-8,17-18H,1-4H2
InChIKeySRRUYJSDFUVGNL-UHFFFAOYSA-N
MW280.21 g/mol
LogP2.64
Rot. Bonds2

About 2,2,2-trifluoro-1-[4-(2,2,2-trifluoro-1-hydroxyethyl)cyclohexyl]ethanol

2,2,2-trifluoro-1-[4-(2,2,2-trifluoro-1-hydroxyethyl)cyclohexyl]ethanol (PubChem CID 59850747) has the molecular formula C10H14F6O2 and a molecular weight of 280.21 g/mol. Its IUPAC name is 2,2,2-trifluoro-1-[4-(2,2,2-trifluoro-1-hydroxyethyl)cyclohexyl]ethanol.

Molecular Properties

Compound Name2,2,2-trifluoro-1-[4-(2,2,2-trifluoro-1-hydroxyethyl)cyclohexyl]ethanol
PubChem CID59850747
Molecular FormulaC10H14F6O2
Molecular Weight280.21 g/mol
Exact Mass280.09
IUPAC Name2,2,2-trifluoro-1-[4-(2,2,2-trifluoro-1-hydroxyethyl)cyclohexyl]ethanol
SMILESOC(C1CCC(C(O)C(F)(F)F)CC1)C(F)(F)F
InChIInChI=1S/C10H14F6O2/c11-9(12,13)7(17)5-1-2-6(4-3-5)8(18)10(14,15)16/h5-8,17-18H,1-4H2
InChIKeySRRUYJSDFUVGNL-UHFFFAOYSA-N
XLogP2.64
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.21
LogP ≤ 52.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,2,2-trifluoro-1-[4-(2,2,2-trifluoro-1-hydroxyethyl)cyclohexyl]ethanol?
The IUPAC name of 2,2,2-trifluoro-1-[4-(2,2,2-trifluoro-1-hydroxyethyl)cyclohexyl]ethanol (CID 59850747) is 2,2,2-trifluoro-1-[4-(2,2,2-trifluoro-1-hydroxyethyl)cyclohexyl]ethanol.
What is the SMILES notation for 2,2,2-trifluoro-1-[4-(2,2,2-trifluoro-1-hydroxyethyl)cyclohexyl]ethanol?
The canonical SMILES for 2,2,2-trifluoro-1-[4-(2,2,2-trifluoro-1-hydroxyethyl)cyclohexyl]ethanol is OC(C1CCC(C(O)C(F)(F)F)CC1)C(F)(F)F.
What is the InChIKey of 2,2,2-trifluoro-1-[4-(2,2,2-trifluoro-1-hydroxyethyl)cyclohexyl]ethanol?
The InChIKey is SRRUYJSDFUVGNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14F6O2/c11-9(12,13)7(17)5-1-2-6(4-3-5)8(18)10(14,15)16/h5-8,17-18H,1-4H2.
What are the key properties of 2,2,2-trifluoro-1-[4-(2,2,2-trifluoro-1-hydroxyethyl)cyclohexyl]ethanol?
2,2,2-trifluoro-1-[4-(2,2,2-trifluoro-1-hydroxyethyl)cyclohexyl]ethanol has a molecular weight of 280.21 g/mol, XLogP of 2.64, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,2-trifluoro-1-[4-(2,2,2-trifluoro-1-hydroxyethyl)cyclohexyl]ethanol is sourced from PubChem (CID 59850747), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).