2-[(E)-2-phenyl-2-[4-(trifluoromethyl)phenyl]ethenyl]oxolane

C19H17F3O — CID 132915994

IUPAC2-[(E)-2-phenyl-2-[4-(trifluoromethyl)phenyl]ethenyl]oxolane
SMILESFC(F)(F)c1ccc(/C(=C/C2CCCO2)c2ccccc2)cc1
InChIInChI=1S/C19H17F3O/c20-19(21,22)16-10-8-15(9-11-16)18(13-17-7-4-12-23-17)14-5-2-1-3-6-14/h1-3,5-6,8-11,13,17H,4,7,12H2/b18-13+
InChIKeyROOBNHFLDYMDCG-QGOAFFKASA-N
MW318.34 g/mol
LogP5.32
Rot. Bonds3

About 2-[(E)-2-phenyl-2-[4-(trifluoromethyl)phenyl]ethenyl]oxolane

2-[(E)-2-phenyl-2-[4-(trifluoromethyl)phenyl]ethenyl]oxolane (PubChem CID 132915994) has the molecular formula C19H17F3O and a molecular weight of 318.34 g/mol. Its IUPAC name is 2-[(E)-2-phenyl-2-[4-(trifluoromethyl)phenyl]ethenyl]oxolane.

Molecular Properties

Compound Name2-[(E)-2-phenyl-2-[4-(trifluoromethyl)phenyl]ethenyl]oxolane
PubChem CID132915994
Molecular FormulaC19H17F3O
Molecular Weight318.34 g/mol
Exact Mass318.12
IUPAC Name2-[(E)-2-phenyl-2-[4-(trifluoromethyl)phenyl]ethenyl]oxolane
SMILESFC(F)(F)c1ccc(/C(=C/C2CCCO2)c2ccccc2)cc1
InChIInChI=1S/C19H17F3O/c20-19(21,22)16-10-8-15(9-11-16)18(13-17-7-4-12-23-17)14-5-2-1-3-6-14/h1-3,5-6,8-11,13,17H,4,7,12H2/b18-13+
InChIKeyROOBNHFLDYMDCG-QGOAFFKASA-N
XLogP5.32
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500318.34
LogP ≤ 55.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

3-phenyl-3-[4-(trifluoromethyl)phenyl]prop-2-en-1-ol
CID 68849939
CID 101352816
CID 101352816
1,2-bis[2-[2-[(Z)-2-phenyl-2-[4-(trifluoromethyl)phenyl]ethenyl]phenyl]ethenyl]benzene
CID 160707520
2-[4-(trifluoromethyl)phenyl]oxolane
CID 72665644
2-(oxolan-2-yl)-1-[4-(trifluoromethyl)phenyl]ethanone
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2-(oxolan-2-yl)-1-[4-(trifluoromethyl)phenyl]ethanol
CID 62791649
CID 161391832
CID 161391832
(2E,4Z)-5-(3-cyclobutyloxyphenyl)-5-[4-(trifluoromethyl)phenyl]penta-2,4-dienoic acid
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3-(chloromethyl)-2-[4-(trifluoromethyl)phenyl]oxane
CID 79373159
(2S)-N-[4-(trifluoromethyl)phenyl]oxolane-2-carboxamide
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CID 175759950

Frequently Asked Questions

What is the IUPAC name of 2-[(E)-2-phenyl-2-[4-(trifluoromethyl)phenyl]ethenyl]oxolane?
The IUPAC name of 2-[(E)-2-phenyl-2-[4-(trifluoromethyl)phenyl]ethenyl]oxolane (CID 132915994) is 2-[(E)-2-phenyl-2-[4-(trifluoromethyl)phenyl]ethenyl]oxolane.
What is the SMILES notation for 2-[(E)-2-phenyl-2-[4-(trifluoromethyl)phenyl]ethenyl]oxolane?
The canonical SMILES for 2-[(E)-2-phenyl-2-[4-(trifluoromethyl)phenyl]ethenyl]oxolane is FC(F)(F)c1ccc(/C(=C/C2CCCO2)c2ccccc2)cc1.
What is the InChIKey of 2-[(E)-2-phenyl-2-[4-(trifluoromethyl)phenyl]ethenyl]oxolane?
The InChIKey is ROOBNHFLDYMDCG-QGOAFFKASA-N. The full InChI is InChI=1S/C19H17F3O/c20-19(21,22)16-10-8-15(9-11-16)18(13-17-7-4-12-23-17)14-5-2-1-3-6-14/h1-3,5-6,8-11,13,17H,4,7,12H2/b18-13+.
What are the key properties of 2-[(E)-2-phenyl-2-[4-(trifluoromethyl)phenyl]ethenyl]oxolane?
2-[(E)-2-phenyl-2-[4-(trifluoromethyl)phenyl]ethenyl]oxolane has a molecular weight of 318.34 g/mol, XLogP of 5.32, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(E)-2-phenyl-2-[4-(trifluoromethyl)phenyl]ethenyl]oxolane is sourced from PubChem (CID 132915994), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).