Ethane-1,2-diol;ethene;ethoxyethane

C₁₀H₂₄O₃ — CID 173009607

About Ethane-1,2-diol;ethene;ethoxyethane

Ethane-1,2-diol;ethene;ethoxyethane (PubChem CID 173009607) has the molecular formula C₁₀H₂₄O₃ and a molecular weight of 192.30 g/mol. Its IUPAC name is ethane-1,2-diol;ethene;ethoxyethane.

Molecular Properties

• Compound Name: Ethane-1,2-diol;ethene;ethoxyethane
• PubChem CID: 173009607
• Molecular Formula: C₁₀H₂₄O₃
• Molecular Weight: 192.30 g/mol
• Exact Mass: 192.17
• IUPAC Name: ethane-1,2-diol;ethene;ethoxyethane
• SMILES: C=C.C=C.CCOCC.OCCO
• InChI: InChI=1S/C4H10O.C2H6O2.2C2H4/c1-3-5-4-2;3-1-2-4;2*1-2/h3-4H2,1-2H3;3-4H,1-2H2;2*1-2H2
• InChIKey: ZTLATWRFZBYBMA-UHFFFAOYSA-N
• XLogP: 1.62
• TPSA: 49.69 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 3
• Rotatable Bonds: 3
• Heavy Atoms: 13
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	192.30
LogP ≤ 5	1.62
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	3

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of Ethane-1,2-diol;ethene;ethoxyethane?

The IUPAC name of Ethane-1,2-diol;ethene;ethoxyethane (CID 173009607) is ethane-1,2-diol;ethene;ethoxyethane.

What is the SMILES notation for Ethane-1,2-diol;ethene;ethoxyethane?

The canonical SMILES for Ethane-1,2-diol;ethene;ethoxyethane is C=C.C=C.CCOCC.OCCO.

What is the InChIKey of Ethane-1,2-diol;ethene;ethoxyethane?

The InChIKey is ZTLATWRFZBYBMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10O.C2H6O2.2C2H4/c1-3-5-4-2;3-1-2-4;2*1-2/h3-4H2,1-2H3;3-4H,1-2H2;2*1-2H2.

What are the key properties of Ethane-1,2-diol;ethene;ethoxyethane?

Ethane-1,2-diol;ethene;ethoxyethane has a molecular weight of 192.30 g/mol, XLogP of 1.62, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.

Where does this data come from?

All data for Ethane-1,2-diol;ethene;ethoxyethane is sourced from PubChem (CID 173009607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 173009607 — identifiers, structure, computed properties (public domain)

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