2-(2-methylprop-1-enoxy)ethoxycyclobutane

C₁₀H₁₈O₂ — CID 151499335

About 2-(2-methylprop-1-enoxy)ethoxycyclobutane

2-(2-methylprop-1-enoxy)ethoxycyclobutane (PubChem CID 151499335) has the molecular formula C₁₀H₁₈O₂ and a molecular weight of 170.25 g/mol. Its IUPAC name is 2-(2-methylprop-1-enoxy)ethoxycyclobutane.

Molecular Properties

• Compound Name: 2-(2-methylprop-1-enoxy)ethoxycyclobutane
• PubChem CID: 151499335
• Molecular Formula: C₁₀H₁₈O₂
• Molecular Weight: 170.25 g/mol
• Exact Mass: 170.13
• IUPAC Name: 2-(2-methylprop-1-enoxy)ethoxycyclobutane
• SMILES: CC(C)=COCCOC1CCC1
• InChI: InChI=1S/C10H18O2/c1-9(2)8-11-6-7-12-10-4-3-5-10/h8,10H,3-7H2,1-2H3
• InChIKey: PQBVAHZAEYEPKX-UHFFFAOYSA-N
• XLogP: 2.50
• TPSA: 18.46 Ų
• H-Bond Acceptors: 2
• Rotatable Bonds: 5
• Heavy Atoms: 12
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	170.25
LogP ≤ 5	2.50
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	2

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2-(2-methylprop-1-enoxy)ethoxycyclobutane?

The IUPAC name of 2-(2-methylprop-1-enoxy)ethoxycyclobutane (CID 151499335) is 2-(2-methylprop-1-enoxy)ethoxycyclobutane.

What is the SMILES notation for 2-(2-methylprop-1-enoxy)ethoxycyclobutane?

The canonical SMILES for 2-(2-methylprop-1-enoxy)ethoxycyclobutane is CC(C)=COCCOC1CCC1.

What is the InChIKey of 2-(2-methylprop-1-enoxy)ethoxycyclobutane?

The InChIKey is PQBVAHZAEYEPKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18O2/c1-9(2)8-11-6-7-12-10-4-3-5-10/h8,10H,3-7H2,1-2H3.

What are the key properties of 2-(2-methylprop-1-enoxy)ethoxycyclobutane?

2-(2-methylprop-1-enoxy)ethoxycyclobutane has a molecular weight of 170.25 g/mol, XLogP of 2.50, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.

Where does this data come from?

All data for 2-(2-methylprop-1-enoxy)ethoxycyclobutane is sourced from PubChem (CID 151499335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 151499335 — identifiers, structure, computed properties (public domain)

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