2-(ethenoxymethyl)-3-methyloxetane

C7H12O2 — CID 141483500

IUPAC2-(ethenoxymethyl)-3-methyloxetane
SMILESC=COCC1OCC1C
InChIInChI=1S/C7H12O2/c1-3-8-5-7-6(2)4-9-7/h3,6-7H,1,4-5H2,2H3
InChIKeyUSWQDEDCTYSGDH-UHFFFAOYSA-N
MW128.17 g/mol
LogP1.18
Rot. Bonds3

About 2-(ethenoxymethyl)-3-methyloxetane

2-(ethenoxymethyl)-3-methyloxetane (PubChem CID 141483500) has the molecular formula C7H12O2 and a molecular weight of 128.17 g/mol. Its IUPAC name is 2-(ethenoxymethyl)-3-methyloxetane.

Molecular Properties

Compound Name2-(ethenoxymethyl)-3-methyloxetane
PubChem CID141483500
Molecular FormulaC7H12O2
Molecular Weight128.17 g/mol
Exact Mass128.08
IUPAC Name2-(ethenoxymethyl)-3-methyloxetane
SMILESC=COCC1OCC1C
InChIInChI=1S/C7H12O2/c1-3-8-5-7-6(2)4-9-7/h3,6-7H,1,4-5H2,2H3
InChIKeyUSWQDEDCTYSGDH-UHFFFAOYSA-N
XLogP1.18
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.17
LogP ≤ 51.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-(2-Ethenoxyethoxymethyl)-3-methyloxetane
CID 69936827
2-(Ethoxymethyl)-3-methyloxetane
CID 89027477
2-(Methoxymethyl)-3-methyloxetane
CID 91216087
2-(Ethenoxymethyl)oxetane
CID 141286443
3-(Ethenoxymethyl)-2-methyloxetane
CID 141483495
2-(Ethenoxymethyl)-2-methyloxetane
CID 141483507
2-(Ethenoxymethyl)-3-ethyloxetane
CID 141483508

Frequently Asked Questions

What is the IUPAC name of 2-(ethenoxymethyl)-3-methyloxetane?
The IUPAC name of 2-(ethenoxymethyl)-3-methyloxetane (CID 141483500) is 2-(ethenoxymethyl)-3-methyloxetane.
What is the SMILES notation for 2-(ethenoxymethyl)-3-methyloxetane?
The canonical SMILES for 2-(ethenoxymethyl)-3-methyloxetane is C=COCC1OCC1C.
What is the InChIKey of 2-(ethenoxymethyl)-3-methyloxetane?
The InChIKey is USWQDEDCTYSGDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12O2/c1-3-8-5-7-6(2)4-9-7/h3,6-7H,1,4-5H2,2H3.
What are the key properties of 2-(ethenoxymethyl)-3-methyloxetane?
2-(ethenoxymethyl)-3-methyloxetane has a molecular weight of 128.17 g/mol, XLogP of 1.18, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethenoxymethyl)-3-methyloxetane is sourced from PubChem (CID 141483500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).