1,2-Epoxyeicosane
Product Information
Molecular Formula
C20H40O
Molecular Weight
296.53
Description
1,2-Epoxyeicosane is novel synthetic compound in biomedicine. Particularly useful in cancer research, it aids in the exploration of lipid metabolism pathways. Further, it helps understand irregular cellular functions in certain cancerous cells.
Synonyms
1,2-EPOXYEICOSANE; 1,2-EICOSYLENE OXIDE; Epoxyeicosane; octadecyloxirane; 1,2-EPOXYEICOSANE 80+%; 1,2-Epoxyicosane; Einecs 243-297-4
IUPAC Name
2-octadecyloxirane
SMILES
CCCCCCCCCCCCCCCCCCC1CO1
InChI
InChI=1S/C20H40O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-20-19-21-20/h20H,2-19H2,1H3
InChI Key
BHZBVWCLMYQFQX-UHFFFAOYSA-N
Purity
>80.0%(GC)
Appearance
White to Almost white powder to lump
Storage
0-10°C
Computed Properties
XLogP3
9.5
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
1
Rotatable Bond Count
17
Exact Mass
296.307915895 g/mol
Monoisotopic Mass
296.307915895 g/mol
Topological Polar Surface Area
12.5Ų
Heavy Atom Count
21
Formal Charge
0
Complexity
202
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
1
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
1
Compound Is Canonicalized
Yes
