3-(methoxymethyl)-2-methyloxetane

C6H12O2 — CID 141096113

IUPAC3-(methoxymethyl)-2-methyloxetane
SMILESCOCC1COC1C
InChIInChI=1S/C6H12O2/c1-5-6(3-7-2)4-8-5/h5-6H,3-4H2,1-2H3
InChIKeyIZUJCDJDHIKMJJ-UHFFFAOYSA-N
MW116.16 g/mol
LogP0.67
Rot. Bonds2

About 3-(methoxymethyl)-2-methyloxetane

3-(methoxymethyl)-2-methyloxetane (PubChem CID 141096113) has the molecular formula C6H12O2 and a molecular weight of 116.16 g/mol. Its IUPAC name is 3-(methoxymethyl)-2-methyloxetane.

Molecular Properties

Compound Name3-(methoxymethyl)-2-methyloxetane
PubChem CID141096113
Molecular FormulaC6H12O2
Molecular Weight116.16 g/mol
Exact Mass116.08
IUPAC Name3-(methoxymethyl)-2-methyloxetane
SMILESCOCC1COC1C
InChIInChI=1S/C6H12O2/c1-5-6(3-7-2)4-8-5/h5-6H,3-4H2,1-2H3
InChIKeyIZUJCDJDHIKMJJ-UHFFFAOYSA-N
XLogP0.67
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500116.16
LogP ≤ 50.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(methoxymethyl)-2-methyloxetane?
The IUPAC name of 3-(methoxymethyl)-2-methyloxetane (CID 141096113) is 3-(methoxymethyl)-2-methyloxetane.
What is the SMILES notation for 3-(methoxymethyl)-2-methyloxetane?
The canonical SMILES for 3-(methoxymethyl)-2-methyloxetane is COCC1COC1C.
What is the InChIKey of 3-(methoxymethyl)-2-methyloxetane?
The InChIKey is IZUJCDJDHIKMJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12O2/c1-5-6(3-7-2)4-8-5/h5-6H,3-4H2,1-2H3.
What are the key properties of 3-(methoxymethyl)-2-methyloxetane?
3-(methoxymethyl)-2-methyloxetane has a molecular weight of 116.16 g/mol, XLogP of 0.67, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(methoxymethyl)-2-methyloxetane is sourced from PubChem (CID 141096113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).