Ethanone, 1-[4-(1,2,3,4-tetrahydroxybutyl)-1H-imidazol-2-yl]-,[1R-(1R*,2S*,3R*)]-


Chemical Name: Ethanone, 1-[4-(1,2,3,4-tetrahydroxybutyl)-1H-imidazol-2-yl]-,[1R-(1R*,2S*,3R*)]-
CAS Number: 94944-70-4
Product Number: AG005U25(AGN-PC-0W4KC2)
Synonyms:
MDL No:
Molecular Formula: C9H14N2O5
Molecular Weight: 230.2179

Identification/Properties


Properties
MP:
>200ºC (dec.)
Storage:
-10 ℃;
Form:
Solid
Computed Properties
Molecular Weight:
230.22g/mol
XLogP3:
-2.7
Hydrogen Bond Donor Count:
5
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
5
Exact Mass:
230.09g/mol
Monoisotopic Mass:
230.09g/mol
Topological Polar Surface Area:
127A^2
Heavy Atom Count:
16
Formal Charge:
0
Complexity:
250
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
3
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
N/A
Signal Word:
UN#:
N/A
Hazard Statements:
-
Precautionary Statements:
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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Chemical Structure



1-(5-((1R,2S,3R)-1,2,3,4-Tetrahydroxybutyl)-1H-imidazol-2-yl)ethanone is a versatile compound widely used in chemical synthesis. It serves as a key building block in the creation of various complex organic molecules due to its unique structural properties. In the realm of chemical synthesis, this compound acts as a valuable intermediate for the formation of biologically active compounds, pharmaceutical ingredients, and specialty chemicals. By incorporating this compound into synthesis pathways, chemists can efficiently generate novel molecules with specific functionalities and properties for various industrial applications.