2-[2-(2-methylprop-1-enoxy)ethyl]oxetane

C9H16O2 — CID 150089785

IUPAC2-[2-(2-methylprop-1-enoxy)ethyl]oxetane
SMILESCC(C)=COCCC1CCO1
InChIInChI=1S/C9H16O2/c1-8(2)7-10-5-3-9-4-6-11-9/h7,9H,3-6H2,1-2H3
InChIKeyDSZAGZFXHOBWFB-UHFFFAOYSA-N
MW156.22 g/mol
LogP2.11
Rot. Bonds4

About 2-[2-(2-methylprop-1-enoxy)ethyl]oxetane

2-[2-(2-methylprop-1-enoxy)ethyl]oxetane (PubChem CID 150089785) has the molecular formula C9H16O2 and a molecular weight of 156.22 g/mol. Its IUPAC name is 2-[2-(2-methylprop-1-enoxy)ethyl]oxetane.

Molecular Properties

Compound Name2-[2-(2-methylprop-1-enoxy)ethyl]oxetane
PubChem CID150089785
Molecular FormulaC9H16O2
Molecular Weight156.22 g/mol
Exact Mass156.12
IUPAC Name2-[2-(2-methylprop-1-enoxy)ethyl]oxetane
SMILESCC(C)=COCCC1CCO1
InChIInChI=1S/C9H16O2/c1-8(2)7-10-5-3-9-4-6-11-9/h7,9H,3-6H2,1-2H3
InChIKeyDSZAGZFXHOBWFB-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

2,3,3-Trifluoro-4-[2-(2-methylprop-1-enoxy)ethyl]oxetane
CID 150035645
2,4-Difluoro-2-[2-(2-methylprop-1-enoxy)ethyl]oxetane
CID 150190710
2,3-Difluoro-4-[2-(2-methylprop-1-enoxy)ethyl]oxetane
CID 150198232
2,2,3-Trifluoro-4-[2-(2-methylprop-1-enoxy)ethyl]oxetane
CID 151317514
2,2,3,3-Tetrafluoro-4-[2-(2-methylprop-1-enoxy)ethyl]oxetane
CID 151646928
2,3-Difluoro-2-[2-(2-methylprop-1-enoxy)ethyl]oxetane
CID 151998660
2-(2-Prop-1-enoxyethyl)oxetane
CID 141062647
2-Methyl-2-[2-(2-methylprop-1-enoxy)ethyl]oxetane
CID 150076792
3-Methyl-2-[2-(2-methylprop-1-enoxy)ethyl]oxetane
CID 150247617
2-[2-(3-Methylbut-1-enoxy)ethyl]oxetane
CID 150963563
2-Ethyl-4-[2-(2-methylprop-1-enoxy)ethyl]oxetane
CID 151197075
2-Ethyl-2-[2-(2-methylprop-1-enoxy)ethyl]oxetane
CID 151447757

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-methylprop-1-enoxy)ethyl]oxetane?
The IUPAC name of 2-[2-(2-methylprop-1-enoxy)ethyl]oxetane (CID 150089785) is 2-[2-(2-methylprop-1-enoxy)ethyl]oxetane.
What is the SMILES notation for 2-[2-(2-methylprop-1-enoxy)ethyl]oxetane?
The canonical SMILES for 2-[2-(2-methylprop-1-enoxy)ethyl]oxetane is CC(C)=COCCC1CCO1.
What is the InChIKey of 2-[2-(2-methylprop-1-enoxy)ethyl]oxetane?
The InChIKey is DSZAGZFXHOBWFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16O2/c1-8(2)7-10-5-3-9-4-6-11-9/h7,9H,3-6H2,1-2H3.
What are the key properties of 2-[2-(2-methylprop-1-enoxy)ethyl]oxetane?
2-[2-(2-methylprop-1-enoxy)ethyl]oxetane 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-(2-methylprop-1-enoxy)ethyl]oxetane is sourced from PubChem (CID 150089785), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).