2,5-bis(1-methoxyethenyl)oxolane

C10H16O3 — CID 118047548

IUPAC2,5-bis(1-methoxyethenyl)oxolane
SMILESC=C(OC)C1CCC(C(=C)OC)O1
InChIInChI=1S/C10H16O3/c1-7(11-3)9-5-6-10(13-9)8(2)12-4/h9-10H,1-2,5-6H2,3-4H3
InChIKeyYYCXSDJTHASPEJ-UHFFFAOYSA-N
MW184.23 g/mol
LogP1.85
Rot. Bonds4

About 2,5-bis(1-methoxyethenyl)oxolane

2,5-bis(1-methoxyethenyl)oxolane (PubChem CID 118047548) has the molecular formula C10H16O3 and a molecular weight of 184.23 g/mol. Its IUPAC name is 2,5-bis(1-methoxyethenyl)oxolane.

Molecular Properties

Compound Name2,5-bis(1-methoxyethenyl)oxolane
PubChem CID118047548
Molecular FormulaC10H16O3
Molecular Weight184.23 g/mol
Exact Mass184.11
IUPAC Name2,5-bis(1-methoxyethenyl)oxolane
SMILESC=C(OC)C1CCC(C(=C)OC)O1
InChIInChI=1S/C10H16O3/c1-7(11-3)9-5-6-10(13-9)8(2)12-4/h9-10H,1-2,5-6H2,3-4H3
InChIKeyYYCXSDJTHASPEJ-UHFFFAOYSA-N
XLogP1.85
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.23
LogP ≤ 51.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2,5-bis(1-methoxyethenyl)oxolane?
The IUPAC name of 2,5-bis(1-methoxyethenyl)oxolane (CID 118047548) is 2,5-bis(1-methoxyethenyl)oxolane.
What is the SMILES notation for 2,5-bis(1-methoxyethenyl)oxolane?
The canonical SMILES for 2,5-bis(1-methoxyethenyl)oxolane is C=C(OC)C1CCC(C(=C)OC)O1.
What is the InChIKey of 2,5-bis(1-methoxyethenyl)oxolane?
The InChIKey is YYCXSDJTHASPEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16O3/c1-7(11-3)9-5-6-10(13-9)8(2)12-4/h9-10H,1-2,5-6H2,3-4H3.
What are the key properties of 2,5-bis(1-methoxyethenyl)oxolane?
2,5-bis(1-methoxyethenyl)oxolane has a molecular weight of 184.23 g/mol, XLogP of 1.85, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-bis(1-methoxyethenyl)oxolane is sourced from PubChem (CID 118047548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).