2-(3,3,3-trifluoropropyl)oxolane

C7H11F3O — CID 15582133

IUPAC2-(3,3,3-trifluoropropyl)oxolane
SMILESFC(F)(F)CCC1CCCO1
InChIInChI=1S/C7H11F3O/c8-7(9,10)4-3-6-2-1-5-11-6/h6H,1-5H2
InChIKeyWWLXHFUWJHRRSE-UHFFFAOYSA-N
MW168.16 g/mol
LogP2.51
Rot. Bonds2

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

2-(3,3,3-trifluoropropyl)oxolane (PubChem CID 15582133) has the molecular formula C7H11F3O and a molecular weight of 168.16 g/mol. Its IUPAC name is 2-(3,3,3-trifluoropropyl)oxolane.

Molecular Properties

Compound Name2-(3,3,3-trifluoropropyl)oxolane
PubChem CID15582133
Molecular FormulaC7H11F3O
Molecular Weight168.16 g/mol
Exact Mass168.08
IUPAC Name2-(3,3,3-trifluoropropyl)oxolane
SMILESFC(F)(F)CCC1CCCO1
InChIInChI=1S/C7H11F3O/c8-7(9,10)4-3-6-2-1-5-11-6/h6H,1-5H2
InChIKeyWWLXHFUWJHRRSE-UHFFFAOYSA-N
XLogP2.51
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.16
LogP ≤ 52.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(3,3,3-trifluoropropyl)oxolane?
The IUPAC name of 2-(3,3,3-trifluoropropyl)oxolane (CID 15582133) is 2-(3,3,3-trifluoropropyl)oxolane.
What is the SMILES notation for 2-(3,3,3-trifluoropropyl)oxolane?
The canonical SMILES for 2-(3,3,3-trifluoropropyl)oxolane is FC(F)(F)CCC1CCCO1.
What is the InChIKey of 2-(3,3,3-trifluoropropyl)oxolane?
The InChIKey is WWLXHFUWJHRRSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11F3O/c8-7(9,10)4-3-6-2-1-5-11-6/h6H,1-5H2.
What are the key properties of 2-(3,3,3-trifluoropropyl)oxolane?
2-(3,3,3-trifluoropropyl)oxolane has a molecular weight of 168.16 g/mol, XLogP of 2.51, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,3,3-trifluoropropyl)oxolane is sourced from PubChem (CID 15582133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).