2-(2-ethenoxyethyl)oxane

C9H16O2 — CID 156762667

IUPAC2-(2-ethenoxyethyl)oxane
SMILESC=COCCC1CCCCO1
InChIInChI=1S/C9H16O2/c1-2-10-8-6-9-5-3-4-7-11-9/h2,9H,1,3-8H2
InChIKeyIADIHXROZKZOMG-UHFFFAOYSA-N
MW156.22 g/mol
LogP2.11
Rot. Bonds4

About 2-(2-ethenoxyethyl)oxane

2-(2-ethenoxyethyl)oxane (PubChem CID 156762667) has the molecular formula C9H16O2 and a molecular weight of 156.22 g/mol. Its IUPAC name is 2-(2-ethenoxyethyl)oxane.

Molecular Properties

Compound Name2-(2-ethenoxyethyl)oxane
PubChem CID156762667
Molecular FormulaC9H16O2
Molecular Weight156.22 g/mol
Exact Mass156.12
IUPAC Name2-(2-ethenoxyethyl)oxane
SMILESC=COCCC1CCCCO1
InChIInChI=1S/C9H16O2/c1-2-10-8-6-9-5-3-4-7-11-9/h2,9H,1,3-8H2
InChIKeyIADIHXROZKZOMG-UHFFFAOYSA-N
XLogP2.11
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.22
LogP ≤ 52.11
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

(2R)-2-(2-methoxyethyl)oxane
CID 58166111
(2S)-2-(2-methoxyethyl)oxane
CID 58166172
2-(2-Methoxyethyl)oxane
CID 66980056
2-(2-Ethoxyethyl)oxane
CID 69343874
1,4,7-Tris(ethenoxy)heptane
CID 88253973
1-Ethenoxy-3-methoxycyclododecane
CID 140049339
3-Ethenoxy-1-methoxyoctane
CID 140099704
2-(4-Ethenoxybutyl)oxane
CID 156762670
2-(3-Ethenoxypropyl)oxane
CID 156762693
2-(1-Ethenoxyethyl)oxane
CID 176603221
2-[2-[(E)-prop-1-enoxy]ethyl]oxane
CID 176605307
2,6-Dimethyloxane;methoxyethene
CID 176673730

Frequently Asked Questions

What is the IUPAC name of 2-(2-ethenoxyethyl)oxane?
The IUPAC name of 2-(2-ethenoxyethyl)oxane (CID 156762667) is 2-(2-ethenoxyethyl)oxane.
What is the SMILES notation for 2-(2-ethenoxyethyl)oxane?
The canonical SMILES for 2-(2-ethenoxyethyl)oxane is C=COCCC1CCCCO1.
What is the InChIKey of 2-(2-ethenoxyethyl)oxane?
The InChIKey is IADIHXROZKZOMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16O2/c1-2-10-8-6-9-5-3-4-7-11-9/h2,9H,1,3-8H2.
What are the key properties of 2-(2-ethenoxyethyl)oxane?
2-(2-ethenoxyethyl)oxane has a molecular weight of 156.22 g/mol, XLogP of 2.11, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethenoxyethyl)oxane is sourced from PubChem (CID 156762667), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).