2,2,3-trifluoro-3-(fluoromethyl)oxirane

C3H2F4O — CID 89191286

IUPAC2,2,3-trifluoro-3-(fluoromethyl)oxirane
SMILESFCC1(F)OC1(F)F
InChIInChI=1S/C3H2F4O/c4-1-2(5)3(6,7)8-2/h1H2
InChIKeyWHQSIJLVZPYDHV-UHFFFAOYSA-N
MW130.04 g/mol
LogP1.24
Rot. Bonds1

About 2,2,3-trifluoro-3-(fluoromethyl)oxirane

2,2,3-trifluoro-3-(fluoromethyl)oxirane (PubChem CID 89191286) has the molecular formula C3H2F4O and a molecular weight of 130.04 g/mol. Its IUPAC name is 2,2,3-trifluoro-3-(fluoromethyl)oxirane.

Molecular Properties

Compound Name2,2,3-trifluoro-3-(fluoromethyl)oxirane
PubChem CID89191286
Molecular FormulaC3H2F4O
Molecular Weight130.04 g/mol
Exact Mass130.00
IUPAC Name2,2,3-trifluoro-3-(fluoromethyl)oxirane
SMILESFCC1(F)OC1(F)F
InChIInChI=1S/C3H2F4O/c4-1-2(5)3(6,7)8-2/h1H2
InChIKeyWHQSIJLVZPYDHV-UHFFFAOYSA-N
XLogP1.24
TPSA12.53 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.04
LogP ≤ 51.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Three-membered_heterocycle', 'substructure': 'N/A'}

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Related Compounds

Hexafluoropropylene oxide
CID 9883
2-Fluoro-2-(trifluoromethyl)oxirane
CID 88593725
2,2,3-Trifluoro-3-(1,1,2,2-tetrafluoroethyl)oxirane
CID 12549350
2-(Trifluoromethyl)-2,3,3-trifluorooxirane
CID 7158888
(3S)-2,2,3-trifluoro-3-(trifluoromethyl)oxirane
CID 7158889
2-(Difluoromethyl)-2,3-difluoro-3-(trifluoromethyl)oxirane
CID 15104122
2-(Difluoromethyl)-2,3,3-trifluorooxirane
CID 17798504
2,2-Difluoro-3-(fluoromethyl)-3-(trifluoromethyl)oxirane
CID 21888608
2,2,3-Trifluoro-3-methyloxirane
CID 22289961
2,2-Difluoro-3-(trifluoromethyl)oxirane
CID 57014101
2,2,3-Trifluoro-3-(1,1,2-trifluoroethyl)oxirane
CID 87220831
2,3-Difluoro-2-(fluoromethyl)-3-(trifluoromethyl)oxirane
CID 87220922

Frequently Asked Questions

What is the IUPAC name of 2,2,3-trifluoro-3-(fluoromethyl)oxirane?
The IUPAC name of 2,2,3-trifluoro-3-(fluoromethyl)oxirane (CID 89191286) is 2,2,3-trifluoro-3-(fluoromethyl)oxirane.
What is the SMILES notation for 2,2,3-trifluoro-3-(fluoromethyl)oxirane?
The canonical SMILES for 2,2,3-trifluoro-3-(fluoromethyl)oxirane is FCC1(F)OC1(F)F.
What is the InChIKey of 2,2,3-trifluoro-3-(fluoromethyl)oxirane?
The InChIKey is WHQSIJLVZPYDHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H2F4O/c4-1-2(5)3(6,7)8-2/h1H2.
What are the key properties of 2,2,3-trifluoro-3-(fluoromethyl)oxirane?
2,2,3-trifluoro-3-(fluoromethyl)oxirane has a molecular weight of 130.04 g/mol, XLogP of 1.24, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,3-trifluoro-3-(fluoromethyl)oxirane is sourced from PubChem (CID 89191286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).