3,3-bis(methoxymethyl)oxetane

C7H14O3 — CID 12721364

IUPAC3,3-bis(methoxymethyl)oxetane
SMILESCOCC1(COC)COC1
InChIInChI=1S/C7H14O3/c1-8-3-7(4-9-2)5-10-6-7/h3-6H2,1-2H3
InChIKeyNDRGXRWCWFISPL-UHFFFAOYSA-N
MW146.19 g/mol
LogP0.30
Rot. Bonds4

About 3,3-bis(methoxymethyl)oxetane

3,3-bis(methoxymethyl)oxetane (PubChem CID 12721364) has the molecular formula C7H14O3 and a molecular weight of 146.19 g/mol. Its IUPAC name is 3,3-bis(methoxymethyl)oxetane.

Molecular Properties

Compound Name3,3-bis(methoxymethyl)oxetane
PubChem CID12721364
Molecular FormulaC7H14O3
Molecular Weight146.19 g/mol
Exact Mass146.09
IUPAC Name3,3-bis(methoxymethyl)oxetane
SMILESCOCC1(COC)COC1
InChIInChI=1S/C7H14O3/c1-8-3-7(4-9-2)5-10-6-7/h3-6H2,1-2H3
InChIKeyNDRGXRWCWFISPL-UHFFFAOYSA-N
XLogP0.30
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.19
LogP ≤ 50.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3,3-bis(methoxymethyl)oxetane?
The IUPAC name of 3,3-bis(methoxymethyl)oxetane (CID 12721364) is 3,3-bis(methoxymethyl)oxetane.
What is the SMILES notation for 3,3-bis(methoxymethyl)oxetane?
The canonical SMILES for 3,3-bis(methoxymethyl)oxetane is COCC1(COC)COC1.
What is the InChIKey of 3,3-bis(methoxymethyl)oxetane?
The InChIKey is NDRGXRWCWFISPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14O3/c1-8-3-7(4-9-2)5-10-6-7/h3-6H2,1-2H3.
What are the key properties of 3,3-bis(methoxymethyl)oxetane?
3,3-bis(methoxymethyl)oxetane has a molecular weight of 146.19 g/mol, XLogP of 0.30, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3-bis(methoxymethyl)oxetane is sourced from PubChem (CID 12721364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).