2-phenyl-2-(2,2,2-trifluoroethoxy)ethanol

C10H11F3O2 — CID 86684706

IUPAC2-phenyl-2-(2,2,2-trifluoroethoxy)ethanol
SMILESOCC(OCC(F)(F)F)c1ccccc1
InChIInChI=1S/C10H11F3O2/c11-10(12,13)7-15-9(6-14)8-4-2-1-3-5-8/h1-5,9,14H,6-7H2
InChIKeyMVEWLYDPMZMSPY-UHFFFAOYSA-N
MW220.19 g/mol
LogP2.30
Rot. Bonds4

About 2-phenyl-2-(2,2,2-trifluoroethoxy)ethanol

2-phenyl-2-(2,2,2-trifluoroethoxy)ethanol (PubChem CID 86684706) has the molecular formula C10H11F3O2 and a molecular weight of 220.19 g/mol. Its IUPAC name is 2-phenyl-2-(2,2,2-trifluoroethoxy)ethanol.

Molecular Properties

Compound Name2-phenyl-2-(2,2,2-trifluoroethoxy)ethanol
PubChem CID86684706
Molecular FormulaC10H11F3O2
Molecular Weight220.19 g/mol
Exact Mass220.07
IUPAC Name2-phenyl-2-(2,2,2-trifluoroethoxy)ethanol
SMILESOCC(OCC(F)(F)F)c1ccccc1
InChIInChI=1S/C10H11F3O2/c11-10(12,13)7-15-9(6-14)8-4-2-1-3-5-8/h1-5,9,14H,6-7H2
InChIKeyMVEWLYDPMZMSPY-UHFFFAOYSA-N
XLogP2.30
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.19
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-phenyl-2-(2,2,2-trifluoroethoxy)ethanol?
The IUPAC name of 2-phenyl-2-(2,2,2-trifluoroethoxy)ethanol (CID 86684706) is 2-phenyl-2-(2,2,2-trifluoroethoxy)ethanol.
What is the SMILES notation for 2-phenyl-2-(2,2,2-trifluoroethoxy)ethanol?
The canonical SMILES for 2-phenyl-2-(2,2,2-trifluoroethoxy)ethanol is OCC(OCC(F)(F)F)c1ccccc1.
What is the InChIKey of 2-phenyl-2-(2,2,2-trifluoroethoxy)ethanol?
The InChIKey is MVEWLYDPMZMSPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11F3O2/c11-10(12,13)7-15-9(6-14)8-4-2-1-3-5-8/h1-5,9,14H,6-7H2.
What are the key properties of 2-phenyl-2-(2,2,2-trifluoroethoxy)ethanol?
2-phenyl-2-(2,2,2-trifluoroethoxy)ethanol has a molecular weight of 220.19 g/mol, XLogP of 2.30, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-2-(2,2,2-trifluoroethoxy)ethanol is sourced from PubChem (CID 86684706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).