Ethanone, 1-[5-[(1R,2S,3R)-1,2,3,4-tetrahydroxybutyl]-1H-imidazol-2-yl]-, oxime, hydrate (1:2), (1E)-

CAS Registry Number®

1078151-47-9
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CAS Name

Ethanone, 1-[5-[(1R,2S,3R)-1,2,3,4-tetrahydroxybutyl]-1H-imidazol-2-yl]-, oxime, hydrate (1:2), (1E)-

Molecular Formula

C9H15N3O5.2H2O

Cite this Page

Ethanone, 1-[5-[(1R,2S,3R)-1,2,3,4-tetrahydroxybutyl]-1H-imidazol-2-yl]-, oxime, hydrate (1:2), (1E)-.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1078151-47-9 (retrieved 2024-05-16) (CAS RN: 1078151-47-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    173-177 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C9H15N3O5.2H2O/c1-4(12-17)9-10-2-5(11-9)7(15)8(16)6(14)3-13;;/h2,6-8,13-17H,3H2,1H3,(H,10,11);2*1H2/b12-4+;;/t6-,7-,8-;;/m1../s1

InChIKey

InChIKey=AJVKDZILVNPFFC-ZQBMOEMVSA-N

SMILES

[C@@H]([C@@H]([C@@H](CO)O)O)(O)C=1NC(\C(=N\O)\C)=NC1.O

Canonical SMILES

O.ON=C(C1=NC=C(N1)C(O)C(O)C(O)CO)C

Other Names for this Substance

  • Ethanone, 1-[5-[(1R,2S,3R)-1,2,3,4-tetrahydroxybutyl]-1H-imidazol-2-yl]-, oxime, hydrate (1:2), (1E)-

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