3-Amino-5-acetylamino-2,4,6-triiodobenzoic acid

CAS Registry Number®

1713-07-1
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CAS Name

3-Amino-5-acetylamino-2,4,6-triiodobenzoic acid

Molecular Formula

C9H7I3N2O3

Molecular Mass

571.88

Cite this Page

3-Amino-5-acetylamino-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=1713-07-1 (retrieved 2024-05-16) (CAS RN: 1713-07-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    258-260 °C (decomp)

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C9H7I3N2O3/c1-2(15)14-8-5(11)3(9(16)17)4(10)7(13)6(8)12/h13H2,1H3,(H,14,15)(H,16,17)

InChIKey

InChIKey=XCNHOBHCZBIGJP-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

O=C(O)C=1C(I)=C(N)C(I)=C(NC(=O)C)C1I

Other Names for this Substance

  • Benzoic acid, 3-(acetylamino)-5-amino-2,4,6-triiodo-
  • Benzoic acid, 3-acetamido-5-amino-2,4,6-triiodo-
  • 3-(Acetylamino)-5-amino-2,4,6-triiodobenzoic acid
  • 2,4,6-Triiodo-3-amino-5-acetamidobenzoic acid
  • 2,4,6-Triiodo-3-acetylamino-5-aminobenzoic acid

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