3,4-bis(prop-1-enoxy)oxolane

C10H16O3 — CID 54398975

IUPAC3,4-bis(prop-1-enoxy)oxolane
SMILESCC=COC1COCC1OC=CC
InChIInChI=1S/C10H16O3/c1-3-5-12-9-7-11-8-10(9)13-6-4-2/h3-6,9-10H,7-8H2,1-2H3
InChIKeyVMAXZUCRDLEGFC-UHFFFAOYSA-N
MW184.23 g/mol
LogP1.85
Rot. Bonds4

About 3,4-bis(prop-1-enoxy)oxolane

3,4-bis(prop-1-enoxy)oxolane (PubChem CID 54398975) has the molecular formula C10H16O3 and a molecular weight of 184.23 g/mol. Its IUPAC name is 3,4-bis(prop-1-enoxy)oxolane.

Molecular Properties

Compound Name3,4-bis(prop-1-enoxy)oxolane
PubChem CID54398975
Molecular FormulaC10H16O3
Molecular Weight184.23 g/mol
Exact Mass184.11
IUPAC Name3,4-bis(prop-1-enoxy)oxolane
SMILESCC=COC1COCC1OC=CC
InChIInChI=1S/C10H16O3/c1-3-5-12-9-7-11-8-10(9)13-6-4-2/h3-6,9-10H,7-8H2,1-2H3
InChIKeyVMAXZUCRDLEGFC-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 3,4-bis(prop-1-enoxy)oxolane?
The IUPAC name of 3,4-bis(prop-1-enoxy)oxolane (CID 54398975) is 3,4-bis(prop-1-enoxy)oxolane.
What is the SMILES notation for 3,4-bis(prop-1-enoxy)oxolane?
The canonical SMILES for 3,4-bis(prop-1-enoxy)oxolane is CC=COC1COCC1OC=CC.
What is the InChIKey of 3,4-bis(prop-1-enoxy)oxolane?
The InChIKey is VMAXZUCRDLEGFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16O3/c1-3-5-12-9-7-11-8-10(9)13-6-4-2/h3-6,9-10H,7-8H2,1-2H3.
What are the key properties of 3,4-bis(prop-1-enoxy)oxolane?
3,4-bis(prop-1-enoxy)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 3,4-bis(prop-1-enoxy)oxolane is sourced from PubChem (CID 54398975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).