2-ethenyl-3-(oxiran-2-yl)oxirane

C6H8O2 — CID 91357720

IUPAC2-ethenyl-3-(oxiran-2-yl)oxirane
SMILESC=CC1OC1C1CO1
InChIInChI=1S/C6H8O2/c1-2-4-6(8-4)5-3-7-5/h2,4-6H,1,3H2
InChIKeyJRKBKZJLUPKYRE-UHFFFAOYSA-N
MW112.13 g/mol
LogP0.34
Rot. Bonds2

About 2-ethenyl-3-(oxiran-2-yl)oxirane

2-ethenyl-3-(oxiran-2-yl)oxirane (PubChem CID 91357720) has the molecular formula C6H8O2 and a molecular weight of 112.13 g/mol. Its IUPAC name is 2-ethenyl-3-(oxiran-2-yl)oxirane.

Molecular Properties

Compound Name2-ethenyl-3-(oxiran-2-yl)oxirane
PubChem CID91357720
Molecular FormulaC6H8O2
Molecular Weight112.13 g/mol
Exact Mass112.05
IUPAC Name2-ethenyl-3-(oxiran-2-yl)oxirane
SMILESC=CC1OC1C1CO1
InChIInChI=1S/C6H8O2/c1-2-4-6(8-4)5-3-7-5/h2,4-6H,1,3H2
InChIKeyJRKBKZJLUPKYRE-UHFFFAOYSA-N
XLogP0.34
TPSA25.06 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500112.13
LogP ≤ 50.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-[1-[1-(Oxiran-2-yl)but-3-enoxy]but-3-enyl]oxirane
CID 11195175
2-Ethenyl-3-(3-hepta-1,3,5-triynyloxiran-2-yl)oxirane
CID 162850722
2-[2-[1-(Oxiran-2-yl)but-3-en-2-yloxy]but-3-enyl]oxirane
CID 18963187
2-[2-Methoxy-1-(3-methoxypropoxy)but-3-enyl]oxirane
CID 20716966
2-[1-[1-(Oxiran-2-yl)prop-2-enoxy]prop-2-enyl]oxirane
CID 53649937
2-Prop-2-enyl-3-[(3-prop-2-enyloxiran-2-yl)methoxymethyl]oxirane
CID 56980724
(2S)-2-[1-[1-[(2S)-oxiran-2-yl]but-3-enoxy]but-3-enyl]oxirane
CID 57107091
2-[1-(2-Prop-2-enoxyethoxy)but-3-enyl]oxirane
CID 60100994
2-[1-(Oxiran-2-yl)but-3-enoxymethyl]oxirane
CID 88363232
2-Ethenyl-3-[(3-ethenyloxiran-2-yl)methoxymethyl]oxirane
CID 88769379
2-(1-Prop-2-enoxyprop-2-enyl)oxirane
CID 89928930
2,5-Bis(ethenyl)-1,4-dioxaspiro[2.2]pentane
CID 140285730

Frequently Asked Questions

What is the IUPAC name of 2-ethenyl-3-(oxiran-2-yl)oxirane?
The IUPAC name of 2-ethenyl-3-(oxiran-2-yl)oxirane (CID 91357720) is 2-ethenyl-3-(oxiran-2-yl)oxirane.
What is the SMILES notation for 2-ethenyl-3-(oxiran-2-yl)oxirane?
The canonical SMILES for 2-ethenyl-3-(oxiran-2-yl)oxirane is C=CC1OC1C1CO1.
What is the InChIKey of 2-ethenyl-3-(oxiran-2-yl)oxirane?
The InChIKey is JRKBKZJLUPKYRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8O2/c1-2-4-6(8-4)5-3-7-5/h2,4-6H,1,3H2.
What are the key properties of 2-ethenyl-3-(oxiran-2-yl)oxirane?
2-ethenyl-3-(oxiran-2-yl)oxirane has a molecular weight of 112.13 g/mol, XLogP of 0.34, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethenyl-3-(oxiran-2-yl)oxirane is sourced from PubChem (CID 91357720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).