2-(2,2,3-trifluoropropyl)oxirane

C5H7F3O — CID 20651951

IUPAC2-(2,2,3-trifluoropropyl)oxirane
SMILESFCC(F)(F)CC1CO1
InChIInChI=1S/C5H7F3O/c6-3-5(7,8)1-4-2-9-4/h4H,1-3H2
InChIKeyIUSHYZISUNGPNE-UHFFFAOYSA-N
MW140.10 g/mol
LogP1.38
Rot. Bonds3

About 2-(2,2,3-trifluoropropyl)oxirane

2-(2,2,3-trifluoropropyl)oxirane (PubChem CID 20651951) has the molecular formula C5H7F3O and a molecular weight of 140.10 g/mol. Its IUPAC name is 2-(2,2,3-trifluoropropyl)oxirane.

Molecular Properties

Compound Name2-(2,2,3-trifluoropropyl)oxirane
PubChem CID20651951
Molecular FormulaC5H7F3O
Molecular Weight140.10 g/mol
Exact Mass140.04
IUPAC Name2-(2,2,3-trifluoropropyl)oxirane
SMILESFCC(F)(F)CC1CO1
InChIInChI=1S/C5H7F3O/c6-3-5(7,8)1-4-2-9-4/h4H,1-3H2
InChIKeyIUSHYZISUNGPNE-UHFFFAOYSA-N
XLogP1.38
TPSA12.53 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.10
LogP ≤ 51.38
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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Frequently Asked Questions

What is the IUPAC name of 2-(2,2,3-trifluoropropyl)oxirane?
The IUPAC name of 2-(2,2,3-trifluoropropyl)oxirane (CID 20651951) is 2-(2,2,3-trifluoropropyl)oxirane.
What is the SMILES notation for 2-(2,2,3-trifluoropropyl)oxirane?
The canonical SMILES for 2-(2,2,3-trifluoropropyl)oxirane is FCC(F)(F)CC1CO1.
What is the InChIKey of 2-(2,2,3-trifluoropropyl)oxirane?
The InChIKey is IUSHYZISUNGPNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7F3O/c6-3-5(7,8)1-4-2-9-4/h4H,1-3H2.
What are the key properties of 2-(2,2,3-trifluoropropyl)oxirane?
2-(2,2,3-trifluoropropyl)oxirane has a molecular weight of 140.10 g/mol, XLogP of 1.38, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,2,3-trifluoropropyl)oxirane is sourced from PubChem (CID 20651951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).