3-[1-[(E)-prop-1-enoxy]ethyl]oxetane

C8H14O2 — CID 176605159

IUPAC3-[1-[(E)-prop-1-enoxy]ethyl]oxetane
SMILESC/C=C/OC(C)C1COC1
InChIInChI=1S/C8H14O2/c1-3-4-10-7(2)8-5-9-6-8/h3-4,7-8H,5-6H2,1-2H3/b4-3+
InChIKeyFYZJYKFWHATDPX-ONEGZZNKSA-N
MW142.20 g/mol
LogP1.57
Rot. Bonds3

About 3-[1-[(E)-prop-1-enoxy]ethyl]oxetane

3-[1-[(E)-prop-1-enoxy]ethyl]oxetane (PubChem CID 176605159) has the molecular formula C8H14O2 and a molecular weight of 142.20 g/mol. Its IUPAC name is 3-[1-[(E)-prop-1-enoxy]ethyl]oxetane.

Molecular Properties

Compound Name3-[1-[(E)-prop-1-enoxy]ethyl]oxetane
PubChem CID176605159
Molecular FormulaC8H14O2
Molecular Weight142.20 g/mol
Exact Mass142.10
IUPAC Name3-[1-[(E)-prop-1-enoxy]ethyl]oxetane
SMILESC/C=C/OC(C)C1COC1
InChIInChI=1S/C8H14O2/c1-3-4-10-7(2)8-5-9-6-8/h3-4,7-8H,5-6H2,1-2H3/b4-3+
InChIKeyFYZJYKFWHATDPX-ONEGZZNKSA-N
XLogP1.57
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.20
LogP ≤ 51.57
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

3-(Prop-1-enoxymethyl)-2-(trifluoromethyl)oxetane
CID 152332459
2-(1-Prop-1-enoxypropan-2-yl)oxirane
CID 149825797
2-Methyl-3-(prop-1-enoxymethyl)oxetane
CID 150708331
3-(Prop-1-enoxymethyl)oxetane
CID 150988666
3-(2-Prop-1-enoxyethyl)oxetane
CID 151635045
3-[1-(2-Methylprop-1-enoxy)ethyl]oxetane
CID 176603608
3-(1-Ethenoxyethyl)oxetane
CID 176604078
3-[[(E)-prop-1-enoxy]methyl]oxetane
CID 176604949
3-[2-[(E)-prop-1-enoxy]ethyl]oxetane
CID 176605240

Frequently Asked Questions

What is the IUPAC name of 3-[1-[(E)-prop-1-enoxy]ethyl]oxetane?
The IUPAC name of 3-[1-[(E)-prop-1-enoxy]ethyl]oxetane (CID 176605159) is 3-[1-[(E)-prop-1-enoxy]ethyl]oxetane.
What is the SMILES notation for 3-[1-[(E)-prop-1-enoxy]ethyl]oxetane?
The canonical SMILES for 3-[1-[(E)-prop-1-enoxy]ethyl]oxetane is C/C=C/OC(C)C1COC1.
What is the InChIKey of 3-[1-[(E)-prop-1-enoxy]ethyl]oxetane?
The InChIKey is FYZJYKFWHATDPX-ONEGZZNKSA-N. The full InChI is InChI=1S/C8H14O2/c1-3-4-10-7(2)8-5-9-6-8/h3-4,7-8H,5-6H2,1-2H3/b4-3+.
What are the key properties of 3-[1-[(E)-prop-1-enoxy]ethyl]oxetane?
3-[1-[(E)-prop-1-enoxy]ethyl]oxetane has a molecular weight of 142.20 g/mol, XLogP of 1.57, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[1-[(E)-prop-1-enoxy]ethyl]oxetane is sourced from PubChem (CID 176605159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).