2-(3-ethenyloxetan-3-yl)oxyethanol

C7H12O3 — CID 162405959

IUPAC2-(3-ethenyloxetan-3-yl)oxyethanol
SMILESC=CC1(OCCO)COC1
InChIInChI=1S/C7H12O3/c1-2-7(5-9-6-7)10-4-3-8/h2,8H,1,3-6H2
InChIKeyNVYCQMYVJBUWKQ-UHFFFAOYSA-N
MW144.17 g/mol
LogP-0.05
Rot. Bonds4

About 2-(3-ethenyloxetan-3-yl)oxyethanol

2-(3-ethenyloxetan-3-yl)oxyethanol (PubChem CID 162405959) has the molecular formula C7H12O3 and a molecular weight of 144.17 g/mol. Its IUPAC name is 2-(3-ethenyloxetan-3-yl)oxyethanol.

Molecular Properties

Compound Name2-(3-ethenyloxetan-3-yl)oxyethanol
PubChem CID162405959
Molecular FormulaC7H12O3
Molecular Weight144.17 g/mol
Exact Mass144.08
IUPAC Name2-(3-ethenyloxetan-3-yl)oxyethanol
SMILESC=CC1(OCCO)COC1
InChIInChI=1S/C7H12O3/c1-2-7(5-9-6-7)10-4-3-8/h2,8H,1,3-6H2
InChIKeyNVYCQMYVJBUWKQ-UHFFFAOYSA-N
XLogP-0.05
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.17
LogP ≤ 5-0.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

3-Ethenyloxetan-3-ol
CID 53484283
(2R)-2-methyl-2-prop-2-enoxybut-3-en-1-ol
CID 10942539
(2R)-2-methoxy-2-methylbut-3-en-1-ol
CID 29924164
Divinyl diethylene glycol
CID 87258459
[(2S)-2-ethenyl-1,4-dioxan-2-yl]methanol
CID 162409992
2-[2-(2-Ethenyl-2-ethoxybut-3-enoxy)ethoxy]ethanol
CID 18471408
2-Methoxy-2-methylbut-3-EN-1-OL
CID 20448587
2-(2-Methoxy-2-methylbut-3-enoxy)-2-methylbut-3-en-1-ol
CID 20697415
2-Methyl-2-prop-2-enoxybut-3-en-1-ol
CID 20697426
2-(2-Methylbut-3-en-2-yloxy)ethanol
CID 87195767
2-[2-(2-Ethenyl-2-methoxybut-3-enoxy)ethoxy]ethanol
CID 87222110
2-Ethenyl-2-[3-(hydroxymethyl)penta-1,4-dien-3-yloxy]but-3-en-1-ol
CID 87835530

Frequently Asked Questions

What is the IUPAC name of 2-(3-ethenyloxetan-3-yl)oxyethanol?
The IUPAC name of 2-(3-ethenyloxetan-3-yl)oxyethanol (CID 162405959) is 2-(3-ethenyloxetan-3-yl)oxyethanol.
What is the SMILES notation for 2-(3-ethenyloxetan-3-yl)oxyethanol?
The canonical SMILES for 2-(3-ethenyloxetan-3-yl)oxyethanol is C=CC1(OCCO)COC1.
What is the InChIKey of 2-(3-ethenyloxetan-3-yl)oxyethanol?
The InChIKey is NVYCQMYVJBUWKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12O3/c1-2-7(5-9-6-7)10-4-3-8/h2,8H,1,3-6H2.
What are the key properties of 2-(3-ethenyloxetan-3-yl)oxyethanol?
2-(3-ethenyloxetan-3-yl)oxyethanol has a molecular weight of 144.17 g/mol, XLogP of -0.05, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-ethenyloxetan-3-yl)oxyethanol is sourced from PubChem (CID 162405959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).