2,4-bis(ethenyl)-1,3-dioxolane

C7H10O2 — CID 89178978

IUPAC2,4-bis(ethenyl)-1,3-dioxolane
SMILESC=CC1COC(C=C)O1
InChIInChI=1S/C7H10O2/c1-3-6-5-8-7(4-2)9-6/h3-4,6-7H,1-2,5H2
InChIKeyNPRHKCGWXJPTIE-UHFFFAOYSA-N
MW126.15 g/mol
LogP1.10
Rot. Bonds2

About 2,4-bis(ethenyl)-1,3-dioxolane

2,4-bis(ethenyl)-1,3-dioxolane (PubChem CID 89178978) has the molecular formula C7H10O2 and a molecular weight of 126.15 g/mol. Its IUPAC name is 2,4-bis(ethenyl)-1,3-dioxolane.

Molecular Properties

Compound Name2,4-bis(ethenyl)-1,3-dioxolane
PubChem CID89178978
Molecular FormulaC7H10O2
Molecular Weight126.15 g/mol
Exact Mass126.07
IUPAC Name2,4-bis(ethenyl)-1,3-dioxolane
SMILESC=CC1COC(C=C)O1
InChIInChI=1S/C7H10O2/c1-3-6-5-8-7(4-2)9-6/h3-4,6-7H,1-2,5H2
InChIKeyNPRHKCGWXJPTIE-UHFFFAOYSA-N
XLogP1.10
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.15
LogP ≤ 51.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2,4-bis(ethenyl)-1,3-dioxolane?
The IUPAC name of 2,4-bis(ethenyl)-1,3-dioxolane (CID 89178978) is 2,4-bis(ethenyl)-1,3-dioxolane.
What is the SMILES notation for 2,4-bis(ethenyl)-1,3-dioxolane?
The canonical SMILES for 2,4-bis(ethenyl)-1,3-dioxolane is C=CC1COC(C=C)O1.
What is the InChIKey of 2,4-bis(ethenyl)-1,3-dioxolane?
The InChIKey is NPRHKCGWXJPTIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10O2/c1-3-6-5-8-7(4-2)9-6/h3-4,6-7H,1-2,5H2.
What are the key properties of 2,4-bis(ethenyl)-1,3-dioxolane?
2,4-bis(ethenyl)-1,3-dioxolane has a molecular weight of 126.15 g/mol, XLogP of 1.10, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-bis(ethenyl)-1,3-dioxolane is sourced from PubChem (CID 89178978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).