2,3,5,6-tetrakis(prop-2-enyl)-1,4-dioxane

C16H24O2 — CID 67208002

IUPAC2,3,5,6-tetrakis(prop-2-enyl)-1,4-dioxane
SMILESC=CCC1OC(CC=C)C(CC=C)OC1CC=C
InChIInChI=1S/C16H24O2/c1-5-9-13-14(10-6-2)18-16(12-8-4)15(17-13)11-7-3/h5-8,13-16H,1-4,9-12H2
InChIKeyNYUBNRWWTXMNEP-UHFFFAOYSA-N
MW248.37 g/mol
LogP3.81
Rot. Bonds8

About 2,3,5,6-tetrakis(prop-2-enyl)-1,4-dioxane

2,3,5,6-tetrakis(prop-2-enyl)-1,4-dioxane (PubChem CID 67208002) has the molecular formula C16H24O2 and a molecular weight of 248.37 g/mol. Its IUPAC name is 2,3,5,6-tetrakis(prop-2-enyl)-1,4-dioxane.

Molecular Properties

Compound Name2,3,5,6-tetrakis(prop-2-enyl)-1,4-dioxane
PubChem CID67208002
Molecular FormulaC16H24O2
Molecular Weight248.37 g/mol
Exact Mass248.18
IUPAC Name2,3,5,6-tetrakis(prop-2-enyl)-1,4-dioxane
SMILESC=CCC1OC(CC=C)C(CC=C)OC1CC=C
InChIInChI=1S/C16H24O2/c1-5-9-13-14(10-6-2)18-16(12-8-4)15(17-13)11-7-3/h5-8,13-16H,1-4,9-12H2
InChIKeyNYUBNRWWTXMNEP-UHFFFAOYSA-N
XLogP3.81
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 53.81
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 2,3,5,6-tetrakis(prop-2-enyl)-1,4-dioxane?
The IUPAC name of 2,3,5,6-tetrakis(prop-2-enyl)-1,4-dioxane (CID 67208002) is 2,3,5,6-tetrakis(prop-2-enyl)-1,4-dioxane.
What is the SMILES notation for 2,3,5,6-tetrakis(prop-2-enyl)-1,4-dioxane?
The canonical SMILES for 2,3,5,6-tetrakis(prop-2-enyl)-1,4-dioxane is C=CCC1OC(CC=C)C(CC=C)OC1CC=C.
What is the InChIKey of 2,3,5,6-tetrakis(prop-2-enyl)-1,4-dioxane?
The InChIKey is NYUBNRWWTXMNEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24O2/c1-5-9-13-14(10-6-2)18-16(12-8-4)15(17-13)11-7-3/h5-8,13-16H,1-4,9-12H2.
What are the key properties of 2,3,5,6-tetrakis(prop-2-enyl)-1,4-dioxane?
2,3,5,6-tetrakis(prop-2-enyl)-1,4-dioxane has a molecular weight of 248.37 g/mol, XLogP of 3.81, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,5,6-tetrakis(prop-2-enyl)-1,4-dioxane is sourced from PubChem (CID 67208002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).