3-ethyl-3-prop-2-enoxyoxetane

C8H14O2 — CID 23614797

IUPAC3-ethyl-3-prop-2-enoxyoxetane
SMILESC=CCOC1(CC)COC1
InChIInChI=1S/C8H14O2/c1-3-5-10-8(4-2)6-9-7-8/h3H,1,4-7H2,2H3
InChIKeyHCGYNTLHOJICFI-UHFFFAOYSA-N
MW142.20 g/mol
LogP1.37
Rot. Bonds4

About 3-ethyl-3-prop-2-enoxyoxetane

3-ethyl-3-prop-2-enoxyoxetane (PubChem CID 23614797) has the molecular formula C8H14O2 and a molecular weight of 142.20 g/mol. Its IUPAC name is 3-ethyl-3-prop-2-enoxyoxetane.

Molecular Properties

Compound Name3-ethyl-3-prop-2-enoxyoxetane
PubChem CID23614797
Molecular FormulaC8H14O2
Molecular Weight142.20 g/mol
Exact Mass142.10
IUPAC Name3-ethyl-3-prop-2-enoxyoxetane
SMILESC=CCOC1(CC)COC1
InChIInChI=1S/C8H14O2/c1-3-5-10-8(4-2)6-9-7-8/h3H,1,4-7H2,2H3
InChIKeyHCGYNTLHOJICFI-UHFFFAOYSA-N
XLogP1.37
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.20
LogP ≤ 51.37
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 3-ethyl-3-prop-2-enoxyoxetane?
The IUPAC name of 3-ethyl-3-prop-2-enoxyoxetane (CID 23614797) is 3-ethyl-3-prop-2-enoxyoxetane.
What is the SMILES notation for 3-ethyl-3-prop-2-enoxyoxetane?
The canonical SMILES for 3-ethyl-3-prop-2-enoxyoxetane is C=CCOC1(CC)COC1.
What is the InChIKey of 3-ethyl-3-prop-2-enoxyoxetane?
The InChIKey is HCGYNTLHOJICFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14O2/c1-3-5-10-8(4-2)6-9-7-8/h3H,1,4-7H2,2H3.
What are the key properties of 3-ethyl-3-prop-2-enoxyoxetane?
3-ethyl-3-prop-2-enoxyoxetane has a molecular weight of 142.20 g/mol, XLogP of 1.37, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-3-prop-2-enoxyoxetane is sourced from PubChem (CID 23614797), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).