2,4,5-tris(ethenyl)-1,3-dioxolane

C9H12O2 — CID 71438911

IUPAC2,4,5-tris(ethenyl)-1,3-dioxolane
SMILESC=CC1OC(C=C)C(C=C)O1
InChIInChI=1S/C9H12O2/c1-4-7-8(5-2)11-9(6-3)10-7/h4-9H,1-3H2
InChIKeyYMMIRJGHLJAYIC-UHFFFAOYSA-N
MW152.19 g/mol
LogP1.65
Rot. Bonds3

About 2,4,5-tris(ethenyl)-1,3-dioxolane

2,4,5-tris(ethenyl)-1,3-dioxolane (PubChem CID 71438911) has the molecular formula C9H12O2 and a molecular weight of 152.19 g/mol. Its IUPAC name is 2,4,5-tris(ethenyl)-1,3-dioxolane.

Molecular Properties

Compound Name2,4,5-tris(ethenyl)-1,3-dioxolane
PubChem CID71438911
Molecular FormulaC9H12O2
Molecular Weight152.19 g/mol
Exact Mass152.08
IUPAC Name2,4,5-tris(ethenyl)-1,3-dioxolane
SMILESC=CC1OC(C=C)C(C=C)O1
InChIInChI=1S/C9H12O2/c1-4-7-8(5-2)11-9(6-3)10-7/h4-9H,1-3H2
InChIKeyYMMIRJGHLJAYIC-UHFFFAOYSA-N
XLogP1.65
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.19
LogP ≤ 51.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 2,4,5-tris(ethenyl)-1,3-dioxolane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(E)-4-methyl-2-(pent-1-enyl)-1,3-dioxolane
CID 5370364
2-Ethenyl-4-methyl-1,3-dioxolane
CID 17025
2-Isobutyl-4-vinyl-1,3-dioxolane
CID 71471386
4-Methyl-2-(1-penten-1-yl)-1,3-dioxolane
CID 574707
(4S)-4-ethenyl-2,2-dimethyl-1,3-dioxolane
CID 6950264
4,5-Divinyl-1,3-dioxolan-2-one
CID 11651165
4-Vinyl-1,3-dioxolane
CID 19388283
2,2-Bis(Trifluoromethyl)-4,5-Divinyl-1,3-Dioxolane
CID 19099814
4,5-Bis(ethenyl)-2-(trifluoromethyl)-1,3-dioxolane
CID 67892977
1,3-Dioxolane, 2,2-dimethyl-4,5-divinyl-
CID 538638
2,4-Bis(ethenyl)-1,3-dioxolane
CID 89178978
4-Ethenyl-2-methyl-1,3-dioxolane;methane
CID 143245598

Frequently Asked Questions

What is the IUPAC name of 2,4,5-tris(ethenyl)-1,3-dioxolane?
The IUPAC name of 2,4,5-tris(ethenyl)-1,3-dioxolane (CID 71438911) is 2,4,5-tris(ethenyl)-1,3-dioxolane.
What is the SMILES notation for 2,4,5-tris(ethenyl)-1,3-dioxolane?
The canonical SMILES for 2,4,5-tris(ethenyl)-1,3-dioxolane is C=CC1OC(C=C)C(C=C)O1.
What is the InChIKey of 2,4,5-tris(ethenyl)-1,3-dioxolane?
The InChIKey is YMMIRJGHLJAYIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12O2/c1-4-7-8(5-2)11-9(6-3)10-7/h4-9H,1-3H2.
What are the key properties of 2,4,5-tris(ethenyl)-1,3-dioxolane?
2,4,5-tris(ethenyl)-1,3-dioxolane has a molecular weight of 152.19 g/mol, XLogP of 1.65, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4,5-tris(ethenyl)-1,3-dioxolane is sourced from PubChem (CID 71438911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).