2-[1-[1-(oxiran-2-yl)ethenoxy]ethenyl]oxirane

C8H10O3 — CID 141006674

IUPAC2-[1-[1-(oxiran-2-yl)ethenoxy]ethenyl]oxirane
SMILESC=C(OC(=C)C1CO1)C1CO1
InChIInChI=1S/C8H10O3/c1-5(7-3-9-7)11-6(2)8-4-10-8/h7-8H,1-4H2
InChIKeyXGCKZFIQHMOKFH-UHFFFAOYSA-N
MW154.16 g/mol
LogP0.83
Rot. Bonds4

About 2-[1-[1-(oxiran-2-yl)ethenoxy]ethenyl]oxirane

2-[1-[1-(oxiran-2-yl)ethenoxy]ethenyl]oxirane (PubChem CID 141006674) has the molecular formula C8H10O3 and a molecular weight of 154.16 g/mol. Its IUPAC name is 2-[1-[1-(oxiran-2-yl)ethenoxy]ethenyl]oxirane.

Molecular Properties

Compound Name2-[1-[1-(oxiran-2-yl)ethenoxy]ethenyl]oxirane
PubChem CID141006674
Molecular FormulaC8H10O3
Molecular Weight154.16 g/mol
Exact Mass154.06
IUPAC Name2-[1-[1-(oxiran-2-yl)ethenoxy]ethenyl]oxirane
SMILESC=C(OC(=C)C1CO1)C1CO1
InChIInChI=1S/C8H10O3/c1-5(7-3-9-7)11-6(2)8-4-10-8/h7-8H,1-4H2
InChIKeyXGCKZFIQHMOKFH-UHFFFAOYSA-N
XLogP0.83
TPSA34.29 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.16
LogP ≤ 50.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-[1-[1-(oxiran-2-yl)ethenoxy]ethenyl]oxirane?
The IUPAC name of 2-[1-[1-(oxiran-2-yl)ethenoxy]ethenyl]oxirane (CID 141006674) is 2-[1-[1-(oxiran-2-yl)ethenoxy]ethenyl]oxirane.
What is the SMILES notation for 2-[1-[1-(oxiran-2-yl)ethenoxy]ethenyl]oxirane?
The canonical SMILES for 2-[1-[1-(oxiran-2-yl)ethenoxy]ethenyl]oxirane is C=C(OC(=C)C1CO1)C1CO1.
What is the InChIKey of 2-[1-[1-(oxiran-2-yl)ethenoxy]ethenyl]oxirane?
The InChIKey is XGCKZFIQHMOKFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10O3/c1-5(7-3-9-7)11-6(2)8-4-10-8/h7-8H,1-4H2.
What are the key properties of 2-[1-[1-(oxiran-2-yl)ethenoxy]ethenyl]oxirane?
2-[1-[1-(oxiran-2-yl)ethenoxy]ethenyl]oxirane has a molecular weight of 154.16 g/mol, XLogP of 0.83, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[1-(oxiran-2-yl)ethenoxy]ethenyl]oxirane is sourced from PubChem (CID 141006674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).