3-ethyl-3-(methoxymethyl)oxetane;3-(methoxymethyl)-3-methyloxetane

C13H26O4 — CID 159055138

IUPAC3-ethyl-3-(methoxymethyl)oxetane;3-(methoxymethyl)-3-methyloxetane
SMILESCCC1(COC)COC1.COCC1(C)COC1
InChIInChI=1S/C7H14O2.C6H12O2/c1-3-7(4-8-2)5-9-6-7;1-6(3-7-2)4-8-5-6/h3-6H2,1-2H3;3-5H2,1-2H3
InChIKeyJXTKYGKOJNYRAN-UHFFFAOYSA-N
MW246.35 g/mol
LogP1.73
Rot. Bonds5

About 3-ethyl-3-(methoxymethyl)oxetane;3-(methoxymethyl)-3-methyloxetane

3-ethyl-3-(methoxymethyl)oxetane;3-(methoxymethyl)-3-methyloxetane (PubChem CID 159055138) has the molecular formula C13H26O4 and a molecular weight of 246.35 g/mol. Its IUPAC name is 3-ethyl-3-(methoxymethyl)oxetane;3-(methoxymethyl)-3-methyloxetane.

Molecular Properties

Compound Name3-ethyl-3-(methoxymethyl)oxetane;3-(methoxymethyl)-3-methyloxetane
PubChem CID159055138
Molecular FormulaC13H26O4
Molecular Weight246.35 g/mol
Exact Mass246.18
IUPAC Name3-ethyl-3-(methoxymethyl)oxetane;3-(methoxymethyl)-3-methyloxetane
SMILESCCC1(COC)COC1.COCC1(C)COC1
InChIInChI=1S/C7H14O2.C6H12O2/c1-3-7(4-8-2)5-9-6-7;1-6(3-7-2)4-8-5-6/h3-6H2,1-2H3;3-5H2,1-2H3
InChIKeyJXTKYGKOJNYRAN-UHFFFAOYSA-N
XLogP1.73
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.35
LogP ≤ 51.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

Oxetane, 3,3'-[oxybis(methylene)]bis[3-ethyl-
CID 9964460
3-Ethyl-3-(4-((3-ethyloxetan-3-yl)methoxy)butoxymethyl)oxetane
CID 20751976
3-Ethyl-3-[2-[(3-ethyloxetan-3-yl)methoxy]ethoxymethyl]oxetane
CID 11253923
3-[2,2-Bis[(3-methyloxetan-3-yl)methoxymethyl]butoxymethyl]-3-methyloxetane
CID 11825221
1,4-Bis-[(3-methyl-3-oxetanyl)methyloxy]butane
CID 14434632
3-Ethyl-3-(propoxymethyl)oxetane
CID 20732660
Triethyl (3-ethyloxetan-3-yl)methyl silicate
CID 20805382
3-Ethyl-3-[1-[(3-ethyloxetan-3-yl)methoxy]propan-2-yloxymethyl]oxetane
CID 21133030
Tetrakis[(3-ethyloxetan-3-yl)methyl] silicate
CID 22098089
Bis[(3-ethyloxetan-3-yl)methoxy]-dimethylsilane
CID 22098112
3,3'-(((2,2-Bis(((3-ethyloxetan-3-yl)methoxy)methyl)propane-1,3-diyl)bis(oxy))bis(methylene))bis(3-ethyloxetane)
CID 22340176
3-[2,2-Bis[(3-ethyloxetan-3-yl)methoxymethyl]butoxymethyl]-3-ethyloxetane
CID 22340181

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-3-(methoxymethyl)oxetane;3-(methoxymethyl)-3-methyloxetane?
The IUPAC name of 3-ethyl-3-(methoxymethyl)oxetane;3-(methoxymethyl)-3-methyloxetane (CID 159055138) is 3-ethyl-3-(methoxymethyl)oxetane;3-(methoxymethyl)-3-methyloxetane.
What is the SMILES notation for 3-ethyl-3-(methoxymethyl)oxetane;3-(methoxymethyl)-3-methyloxetane?
The canonical SMILES for 3-ethyl-3-(methoxymethyl)oxetane;3-(methoxymethyl)-3-methyloxetane is CCC1(COC)COC1.COCC1(C)COC1.
What is the InChIKey of 3-ethyl-3-(methoxymethyl)oxetane;3-(methoxymethyl)-3-methyloxetane?
The InChIKey is JXTKYGKOJNYRAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14O2.C6H12O2/c1-3-7(4-8-2)5-9-6-7;1-6(3-7-2)4-8-5-6/h3-6H2,1-2H3;3-5H2,1-2H3.
What are the key properties of 3-ethyl-3-(methoxymethyl)oxetane;3-(methoxymethyl)-3-methyloxetane?
3-ethyl-3-(methoxymethyl)oxetane;3-(methoxymethyl)-3-methyloxetane has a molecular weight of 246.35 g/mol, XLogP of 1.73, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-3-(methoxymethyl)oxetane;3-(methoxymethyl)-3-methyloxetane is sourced from PubChem (CID 159055138), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).