3-(3-ethenoxypropyl)-3-ethyloxolane

C11H20O2 — CID 176604524

IUPAC3-(3-ethenoxypropyl)-3-ethyloxolane
SMILESC=COCCCC1(CC)CCOC1
InChIInChI=1S/C11H20O2/c1-3-11(7-9-13-10-11)6-5-8-12-4-2/h4H,2-3,5-10H2,1H3
InChIKeyYPUNVXWBYAUPPU-UHFFFAOYSA-N
MW184.28 g/mol
LogP2.74
Rot. Bonds6

About 3-(3-ethenoxypropyl)-3-ethyloxolane

3-(3-ethenoxypropyl)-3-ethyloxolane (PubChem CID 176604524) has the molecular formula C11H20O2 and a molecular weight of 184.28 g/mol. Its IUPAC name is 3-(3-ethenoxypropyl)-3-ethyloxolane.

Molecular Properties

Compound Name3-(3-ethenoxypropyl)-3-ethyloxolane
PubChem CID176604524
Molecular FormulaC11H20O2
Molecular Weight184.28 g/mol
Exact Mass184.15
IUPAC Name3-(3-ethenoxypropyl)-3-ethyloxolane
SMILESC=COCCCC1(CC)CCOC1
InChIInChI=1S/C11H20O2/c1-3-11(7-9-13-10-11)6-5-8-12-4-2/h4H,2-3,5-10H2,1H3
InChIKeyYPUNVXWBYAUPPU-UHFFFAOYSA-N
XLogP2.74
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 52.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

3-(3-Ethenoxypropyl)-3-ethyloxetane
CID 140130461
3-(Ethenoxymethyl)-3-ethyloxane
CID 161788767
2-(Ethenoxymethyl)-2-ethyloxolane
CID 176604059
3-Ethyl-3-[3-(2-methylprop-1-enoxy)propyl]oxolane
CID 176604233
4-(3-Ethenoxypropyl)-4-ethyloxane
CID 176604267
3-(2-Ethenoxyethyl)-3-methyloxolane
CID 176604617
3-(3-Ethenoxypropyl)-3-ethyloxane
CID 176605083
3-ethyl-3-[3-[(E)-prop-1-enoxy]propyl]oxolane
CID 176605133
3-(3-Ethenoxypropyl)oxolane
CID 176605175

Frequently Asked Questions

What is the IUPAC name of 3-(3-ethenoxypropyl)-3-ethyloxolane?
The IUPAC name of 3-(3-ethenoxypropyl)-3-ethyloxolane (CID 176604524) is 3-(3-ethenoxypropyl)-3-ethyloxolane.
What is the SMILES notation for 3-(3-ethenoxypropyl)-3-ethyloxolane?
The canonical SMILES for 3-(3-ethenoxypropyl)-3-ethyloxolane is C=COCCCC1(CC)CCOC1.
What is the InChIKey of 3-(3-ethenoxypropyl)-3-ethyloxolane?
The InChIKey is YPUNVXWBYAUPPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20O2/c1-3-11(7-9-13-10-11)6-5-8-12-4-2/h4H,2-3,5-10H2,1H3.
What are the key properties of 3-(3-ethenoxypropyl)-3-ethyloxolane?
3-(3-ethenoxypropyl)-3-ethyloxolane has a molecular weight of 184.28 g/mol, XLogP of 2.74, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-ethenoxypropyl)-3-ethyloxolane is sourced from PubChem (CID 176604524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).