Methoxyethane;2-methoxyprop-1-ene;2-methylprop-1-ene

C₁₁H₂₄O₂ — CID 54499924

About Methoxyethane;2-methoxyprop-1-ene;2-methylprop-1-ene

Methoxyethane;2-methoxyprop-1-ene;2-methylprop-1-ene (PubChem CID 54499924) has the molecular formula C₁₁H₂₄O₂ and a molecular weight of 188.31 g/mol. Its IUPAC name is methoxyethane;2-methoxyprop-1-ene;2-methylprop-1-ene.

Molecular Properties

• Compound Name: Methoxyethane;2-methoxyprop-1-ene;2-methylprop-1-ene
• PubChem CID: 54499924
• Molecular Formula: C₁₁H₂₄O₂
• Molecular Weight: 188.31 g/mol
• Exact Mass: 188.18
• IUPAC Name: methoxyethane;2-methoxyprop-1-ene;2-methylprop-1-ene
• SMILES: C=C(C)C.C=C(C)OC.CCOC
• InChI: InChI=1S/C4H8O.C4H8.C3H8O/c1-4(2)5-3;1-4(2)3;1-3-4-2/h1H2,2-3H3;1H2,2-3H3;3H2,1-2H3
• InChIKey: YBSALCQENVZDBF-UHFFFAOYSA-N
• XLogP: 3.40
• TPSA: 18.46 Ų
• H-Bond Acceptors: 2
• Rotatable Bonds: 2
• Heavy Atoms: 13
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	188.31
LogP ≤ 5	3.40
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': 'isolated_alkene', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of Methoxyethane;2-methoxyprop-1-ene;2-methylprop-1-ene?

The IUPAC name of Methoxyethane;2-methoxyprop-1-ene;2-methylprop-1-ene (CID 54499924) is methoxyethane;2-methoxyprop-1-ene;2-methylprop-1-ene.

What is the SMILES notation for Methoxyethane;2-methoxyprop-1-ene;2-methylprop-1-ene?

The canonical SMILES for Methoxyethane;2-methoxyprop-1-ene;2-methylprop-1-ene is C=C(C)C.C=C(C)OC.CCOC.

What is the InChIKey of Methoxyethane;2-methoxyprop-1-ene;2-methylprop-1-ene?

The InChIKey is YBSALCQENVZDBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8O.C4H8.C3H8O/c1-4(2)5-3;1-4(2)3;1-3-4-2/h1H2,2-3H3;1H2,2-3H3;3H2,1-2H3.

What are the key properties of Methoxyethane;2-methoxyprop-1-ene;2-methylprop-1-ene?

Methoxyethane;2-methoxyprop-1-ene;2-methylprop-1-ene has a molecular weight of 188.31 g/mol, XLogP of 3.40, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.

Where does this data come from?

All data for Methoxyethane;2-methoxyprop-1-ene;2-methylprop-1-ene is sourced from PubChem (CID 54499924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 54499924 — identifiers, structure, computed properties (public domain)

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