3-(Acetylethylamino)-5-amino-2,4,6-triiodobenzoic acid

CAS Registry Number®

63881-24-3
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CAS Name

3-(Acetylethylamino)-5-amino-2,4,6-triiodobenzoic acid

Molecular Formula

C11H11I3N2O3

Molecular Mass

599.93

Cite this Page

3-(Acetylethylamino)-5-amino-2,4,6-triiodobenzoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=63881-24-3 (retrieved 2024-09-15) (CAS RN: 63881-24-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    259-260 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C11H11I3N2O3/c1-3-16(4(2)17)10-7(13)5(11(18)19)6(12)9(15)8(10)14/h3,15H2,1-2H3,(H,18,19)

InChIKey

InChIKey=KDBIQFLIAZAGBU-UHFFFAOYSA-N

SMILES

N(C(C)=O)(CC)C1=C(I)C(C(O)=O)=C(I)C(N)=C1I

Canonical SMILES

O=C(O)C1=C(I)C(N)=C(I)C(=C1I)N(C(=O)C)CC

Other Names for this Substance

  • Benzoic acid, 3-(acetylethylamino)-5-amino-2,4,6-triiodo-
  • Benzoic acid, 3-amino-5-(N-ethylacetamido)-2,4,6-triiodo-
  • 3-(Acetylethylamino)-5-amino-2,4,6-triiodobenzoic acid