5-propan-2-yl-2-(trifluoromethyl)-2,3-dihydrofuran

C8H11F3O — CID 162563755

IUPAC5-propan-2-yl-2-(trifluoromethyl)-2,3-dihydrofuran
SMILESCC(C)C1=CCC(C(F)(F)F)O1
InChIInChI=1S/C8H11F3O/c1-5(2)6-3-4-7(12-6)8(9,10)11/h3,5,7H,4H2,1-2H3
InChIKeyZMCUASYOWXDQJS-UHFFFAOYSA-N
MW180.17 g/mol
LogP2.88
Rot. Bonds1

About 5-propan-2-yl-2-(trifluoromethyl)-2,3-dihydrofuran

5-propan-2-yl-2-(trifluoromethyl)-2,3-dihydrofuran (PubChem CID 162563755) has the molecular formula C8H11F3O and a molecular weight of 180.17 g/mol. Its IUPAC name is 5-propan-2-yl-2-(trifluoromethyl)-2,3-dihydrofuran.

Molecular Properties

Compound Name5-propan-2-yl-2-(trifluoromethyl)-2,3-dihydrofuran
PubChem CID162563755
Molecular FormulaC8H11F3O
Molecular Weight180.17 g/mol
Exact Mass180.08
IUPAC Name5-propan-2-yl-2-(trifluoromethyl)-2,3-dihydrofuran
SMILESCC(C)C1=CCC(C(F)(F)F)O1
InChIInChI=1S/C8H11F3O/c1-5(2)6-3-4-7(12-6)8(9,10)11/h3,5,7H,4H2,1-2H3
InChIKeyZMCUASYOWXDQJS-UHFFFAOYSA-N
XLogP2.88
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.17
LogP ≤ 52.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

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(2R,6S)-2-propan-2-yl-6-(trifluoromethyl)morpholine-3-thione
CID 95970456
(2S,6S)-2-propan-2-yl-6-(trifluoromethyl)morpholine-3-thione
CID 95970457
(1R)-2,2-dimethyl-1-(2-methyl-2,3-dihydrofuran-5-yl)propan-1-amine
CID 89017378
3,3-dimethyl-5-(trifluoromethyl)oxolan-2-one
CID 11095248
(3R,5R)-3-methyl-5-(trifluoromethyl)oxolan-2-one
CID 131863830
2-methyl-4-(trifluoromethyl)oxetane
CID 162568381
5-[(2R)-3-methylbutan-2-yl]-2-(trifluoromethyl)-2,3-dihydropyridine
CID 118476292
2-fluoro-3-isothiocyanato-5-(trifluoromethyl)cyclohexa-1,3-diene
CID 154545496
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Frequently Asked Questions

What is the IUPAC name of 5-propan-2-yl-2-(trifluoromethyl)-2,3-dihydrofuran?
The IUPAC name of 5-propan-2-yl-2-(trifluoromethyl)-2,3-dihydrofuran (CID 162563755) is 5-propan-2-yl-2-(trifluoromethyl)-2,3-dihydrofuran.
What is the SMILES notation for 5-propan-2-yl-2-(trifluoromethyl)-2,3-dihydrofuran?
The canonical SMILES for 5-propan-2-yl-2-(trifluoromethyl)-2,3-dihydrofuran is CC(C)C1=CCC(C(F)(F)F)O1.
What is the InChIKey of 5-propan-2-yl-2-(trifluoromethyl)-2,3-dihydrofuran?
The InChIKey is ZMCUASYOWXDQJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11F3O/c1-5(2)6-3-4-7(12-6)8(9,10)11/h3,5,7H,4H2,1-2H3.
What are the key properties of 5-propan-2-yl-2-(trifluoromethyl)-2,3-dihydrofuran?
5-propan-2-yl-2-(trifluoromethyl)-2,3-dihydrofuran has a molecular weight of 180.17 g/mol, XLogP of 2.88, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-propan-2-yl-2-(trifluoromethyl)-2,3-dihydrofuran is sourced from PubChem (CID 162563755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).