4-(methoxymethyl)-2-(trifluoromethyl)oxolane

C7H11F3O2 — CID 166528721

IUPAC4-(methoxymethyl)-2-(trifluoromethyl)oxolane
SMILESCOCC1COC(C(F)(F)F)C1
InChIInChI=1S/C7H11F3O2/c1-11-3-5-2-6(12-4-5)7(8,9)10/h5-6H,2-4H2,1H3
InChIKeyZFEHGOQGSOJZJB-UHFFFAOYSA-N
MW184.16 g/mol
LogP1.60
Rot. Bonds2

About 4-(methoxymethyl)-2-(trifluoromethyl)oxolane

4-(methoxymethyl)-2-(trifluoromethyl)oxolane (PubChem CID 166528721) has the molecular formula C7H11F3O2 and a molecular weight of 184.16 g/mol. Its IUPAC name is 4-(methoxymethyl)-2-(trifluoromethyl)oxolane.

Molecular Properties

Compound Name4-(methoxymethyl)-2-(trifluoromethyl)oxolane
PubChem CID166528721
Molecular FormulaC7H11F3O2
Molecular Weight184.16 g/mol
Exact Mass184.07
IUPAC Name4-(methoxymethyl)-2-(trifluoromethyl)oxolane
SMILESCOCC1COC(C(F)(F)F)C1
InChIInChI=1S/C7H11F3O2/c1-11-3-5-2-6(12-4-5)7(8,9)10/h5-6H,2-4H2,1H3
InChIKeyZFEHGOQGSOJZJB-UHFFFAOYSA-N
XLogP1.60
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.16
LogP ≤ 51.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-(methoxymethyl)-2-(trifluoromethyl)oxolane?
The IUPAC name of 4-(methoxymethyl)-2-(trifluoromethyl)oxolane (CID 166528721) is 4-(methoxymethyl)-2-(trifluoromethyl)oxolane.
What is the SMILES notation for 4-(methoxymethyl)-2-(trifluoromethyl)oxolane?
The canonical SMILES for 4-(methoxymethyl)-2-(trifluoromethyl)oxolane is COCC1COC(C(F)(F)F)C1.
What is the InChIKey of 4-(methoxymethyl)-2-(trifluoromethyl)oxolane?
The InChIKey is ZFEHGOQGSOJZJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11F3O2/c1-11-3-5-2-6(12-4-5)7(8,9)10/h5-6H,2-4H2,1H3.
What are the key properties of 4-(methoxymethyl)-2-(trifluoromethyl)oxolane?
4-(methoxymethyl)-2-(trifluoromethyl)oxolane has a molecular weight of 184.16 g/mol, XLogP of 1.60, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(methoxymethyl)-2-(trifluoromethyl)oxolane is sourced from PubChem (CID 166528721), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).