3-(1,1,2,3,3,3-hexafluoropropoxymethyl)-3-methyloxetane

C8H10F6O2 — CID 11172786

IUPAC3-(1,1,2,3,3,3-hexafluoropropoxymethyl)-3-methyloxetane
SMILESCC1(COC(F)(F)C(F)C(F)(F)F)COC1
InChIInChI=1S/C8H10F6O2/c1-6(2-15-3-6)4-16-8(13,14)5(9)7(10,11)12/h5H,2-4H2,1H3
InChIKeyGLOPQWQBLTZHFR-UHFFFAOYSA-N
MW252.15 g/mol
LogP2.53
Rot. Bonds4

About 3-(1,1,2,3,3,3-hexafluoropropoxymethyl)-3-methyloxetane

3-(1,1,2,3,3,3-hexafluoropropoxymethyl)-3-methyloxetane (PubChem CID 11172786) has the molecular formula C8H10F6O2 and a molecular weight of 252.15 g/mol. Its IUPAC name is 3-(1,1,2,3,3,3-hexafluoropropoxymethyl)-3-methyloxetane.

Molecular Properties

Compound Name3-(1,1,2,3,3,3-hexafluoropropoxymethyl)-3-methyloxetane
PubChem CID11172786
Molecular FormulaC8H10F6O2
Molecular Weight252.15 g/mol
Exact Mass252.06
IUPAC Name3-(1,1,2,3,3,3-hexafluoropropoxymethyl)-3-methyloxetane
SMILESCC1(COC(F)(F)C(F)C(F)(F)F)COC1
InChIInChI=1S/C8H10F6O2/c1-6(2-15-3-6)4-16-8(13,14)5(9)7(10,11)12/h5H,2-4H2,1H3
InChIKeyGLOPQWQBLTZHFR-UHFFFAOYSA-N
XLogP2.53
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.15
LogP ≤ 52.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(1,1,2,3,3,3-hexafluoropropoxymethyl)-3-methyloxetane?
The IUPAC name of 3-(1,1,2,3,3,3-hexafluoropropoxymethyl)-3-methyloxetane (CID 11172786) is 3-(1,1,2,3,3,3-hexafluoropropoxymethyl)-3-methyloxetane.
What is the SMILES notation for 3-(1,1,2,3,3,3-hexafluoropropoxymethyl)-3-methyloxetane?
The canonical SMILES for 3-(1,1,2,3,3,3-hexafluoropropoxymethyl)-3-methyloxetane is CC1(COC(F)(F)C(F)C(F)(F)F)COC1.
What is the InChIKey of 3-(1,1,2,3,3,3-hexafluoropropoxymethyl)-3-methyloxetane?
The InChIKey is GLOPQWQBLTZHFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10F6O2/c1-6(2-15-3-6)4-16-8(13,14)5(9)7(10,11)12/h5H,2-4H2,1H3.
What are the key properties of 3-(1,1,2,3,3,3-hexafluoropropoxymethyl)-3-methyloxetane?
3-(1,1,2,3,3,3-hexafluoropropoxymethyl)-3-methyloxetane has a molecular weight of 252.15 g/mol, XLogP of 2.53, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1,1,2,3,3,3-hexafluoropropoxymethyl)-3-methyloxetane is sourced from PubChem (CID 11172786), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).