3-(fluoromethoxy)-2-methyloxetane

C5H9FO2 — CID 21411159

IUPAC3-(fluoromethoxy)-2-methyloxetane
SMILESCC1OCC1OCF
InChIInChI=1S/C5H9FO2/c1-4-5(2-7-4)8-3-6/h4-5H,2-3H2,1H3
InChIKeyZPVGSGRJQPYKOQ-UHFFFAOYSA-N
MW120.12 g/mol
LogP0.72
Rot. Bonds2

About 3-(fluoromethoxy)-2-methyloxetane

3-(fluoromethoxy)-2-methyloxetane (PubChem CID 21411159) has the molecular formula C5H9FO2 and a molecular weight of 120.12 g/mol. Its IUPAC name is 3-(fluoromethoxy)-2-methyloxetane.

Molecular Properties

Compound Name3-(fluoromethoxy)-2-methyloxetane
PubChem CID21411159
Molecular FormulaC5H9FO2
Molecular Weight120.12 g/mol
Exact Mass120.06
IUPAC Name3-(fluoromethoxy)-2-methyloxetane
SMILESCC1OCC1OCF
InChIInChI=1S/C5H9FO2/c1-4-5(2-7-4)8-3-6/h4-5H,2-3H2,1H3
InChIKeyZPVGSGRJQPYKOQ-UHFFFAOYSA-N
XLogP0.72
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500120.12
LogP ≤ 50.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(fluoromethoxy)-2-methyloxetane?
The IUPAC name of 3-(fluoromethoxy)-2-methyloxetane (CID 21411159) is 3-(fluoromethoxy)-2-methyloxetane.
What is the SMILES notation for 3-(fluoromethoxy)-2-methyloxetane?
The canonical SMILES for 3-(fluoromethoxy)-2-methyloxetane is CC1OCC1OCF.
What is the InChIKey of 3-(fluoromethoxy)-2-methyloxetane?
The InChIKey is ZPVGSGRJQPYKOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9FO2/c1-4-5(2-7-4)8-3-6/h4-5H,2-3H2,1H3.
What are the key properties of 3-(fluoromethoxy)-2-methyloxetane?
3-(fluoromethoxy)-2-methyloxetane has a molecular weight of 120.12 g/mol, XLogP of 0.72, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(fluoromethoxy)-2-methyloxetane is sourced from PubChem (CID 21411159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).