But-2-ene;2-(methoxymethyl)oxetane

C₉H₁₈O₂ — CID 159937915

About But-2-ene;2-(methoxymethyl)oxetane

But-2-ene;2-(methoxymethyl)oxetane (PubChem CID 159937915) has the molecular formula C₉H₁₈O₂ and a molecular weight of 158.24 g/mol. Its IUPAC name is but-2-ene;2-(methoxymethyl)oxetane.

Molecular Properties

• Compound Name: But-2-ene;2-(methoxymethyl)oxetane
• PubChem CID: 159937915
• Molecular Formula: C₉H₁₈O₂
• Molecular Weight: 158.24 g/mol
• Exact Mass: 158.13
• IUPAC Name: but-2-ene;2-(methoxymethyl)oxetane
• SMILES: CC=CC.COCC1CCO1
• InChI: InChI=1S/C5H10O2.C4H8/c1-6-4-5-2-3-7-5;1-3-4-2/h5H,2-4H2,1H3;3-4H,1-2H3
• InChIKey: OAMMJORSYFZNFW-UHFFFAOYSA-N
• XLogP: 2.00
• TPSA: 18.46 Ų
• H-Bond Acceptors: 2
• Rotatable Bonds: 2
• Heavy Atoms: 11
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	158.24
LogP ≤ 5	2.00
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	2

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of But-2-ene;2-(methoxymethyl)oxetane?

The IUPAC name of But-2-ene;2-(methoxymethyl)oxetane (CID 159937915) is but-2-ene;2-(methoxymethyl)oxetane.

What is the SMILES notation for But-2-ene;2-(methoxymethyl)oxetane?

The canonical SMILES for But-2-ene;2-(methoxymethyl)oxetane is CC=CC.COCC1CCO1.

What is the InChIKey of But-2-ene;2-(methoxymethyl)oxetane?

The InChIKey is OAMMJORSYFZNFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10O2.C4H8/c1-6-4-5-2-3-7-5;1-3-4-2/h5H,2-4H2,1H3;3-4H,1-2H3.

What are the key properties of But-2-ene;2-(methoxymethyl)oxetane?

But-2-ene;2-(methoxymethyl)oxetane has a molecular weight of 158.24 g/mol, XLogP of 2.00, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.

Where does this data come from?

All data for But-2-ene;2-(methoxymethyl)oxetane is sourced from PubChem (CID 159937915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 159937915 — identifiers, structure, computed properties (public domain)

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