tetrakis(2-ethyloxirane);methane

C20H48O4 — CID 162010408

IUPACtetrakis(2-ethyloxirane);methane
SMILESC.C.C.C.CCC1CO1.CCC1CO1.CCC1CO1.CCC1CO1
InChIInChI=1S/4C4H8O.4CH4/c4*1-2-4-3-5-4;;;;/h4*4H,2-3H2,1H3;4*1H4
InChIKeyYTJXIJOHEWTOQD-UHFFFAOYSA-N
MW352.60 g/mol
LogP5.73
Rot. Bonds4

About tetrakis(2-ethyloxirane);methane

tetrakis(2-ethyloxirane);methane (PubChem CID 162010408) has the molecular formula C20H48O4 and a molecular weight of 352.60 g/mol. Its IUPAC name is tetrakis(2-ethyloxirane);methane.

Molecular Properties

Compound Nametetrakis(2-ethyloxirane);methane
PubChem CID162010408
Molecular FormulaC20H48O4
Molecular Weight352.60 g/mol
Exact Mass352.36
IUPAC Nametetrakis(2-ethyloxirane);methane
SMILESC.C.C.C.CCC1CO1.CCC1CO1.CCC1CO1.CCC1CO1
InChIInChI=1S/4C4H8O.4CH4/c4*1-2-4-3-5-4;;;;/h4*4H,2-3H2,1H3;4*1H4
InChIKeyYTJXIJOHEWTOQD-UHFFFAOYSA-N
XLogP5.73
TPSA50.12 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500352.60
LogP ≤ 55.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Three-membered_heterocycle', 'substructure': 'N/A'}

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Related Compounds

dimethylsilane;2-ethyloxirane
CID 175208147
ethane-1,2-diol;2-ethyloxirane
CID 23290341
ethane;2-ethyloxirane;hexane
CID 91113410
4-ethyl-1,3-dioxolane;methane
CID 158064342
2-ethyl-5-iodo-1,4-dioxane
CID 89143595
but-3-en-2-one;2-ethyloxirane;methane
CID 159927441
2-ethyloxirane;2-hydroxy-1-phosphanylethanethione
CID 158779602
ethane;2-ethyl-1,4-dioxane
CID 170734415
6-ethyl-1,3,5-trioxepane
CID 139790395
bis((2S)-1-chlorobutan-2-olate);(2S)-2-ethyloxirane;bis((2R)-2-ethyloxirane)
CID 157475676
bis(2,7-dimethylnaphthalene);2-ethyloxirane;methane;propane
CID 158649462
ethanol;ethoxymethoxymethanol;2-ethyloxirane;methane;oxiran-2-ylmethanol
CID 158864373

Frequently Asked Questions

What is the IUPAC name of tetrakis(2-ethyloxirane);methane?
The IUPAC name of tetrakis(2-ethyloxirane);methane (CID 162010408) is tetrakis(2-ethyloxirane);methane.
What is the SMILES notation for tetrakis(2-ethyloxirane);methane?
The canonical SMILES for tetrakis(2-ethyloxirane);methane is C.C.C.C.CCC1CO1.CCC1CO1.CCC1CO1.CCC1CO1.
What is the InChIKey of tetrakis(2-ethyloxirane);methane?
The InChIKey is YTJXIJOHEWTOQD-UHFFFAOYSA-N. The full InChI is InChI=1S/4C4H8O.4CH4/c4*1-2-4-3-5-4;;;;/h4*4H,2-3H2,1H3;4*1H4.
What are the key properties of tetrakis(2-ethyloxirane);methane?
tetrakis(2-ethyloxirane);methane has a molecular weight of 352.60 g/mol, XLogP of 5.73, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for tetrakis(2-ethyloxirane);methane is sourced from PubChem (CID 162010408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).