3-Amino-2,4,6-triiodo-5-[(methylamino)carbonyl]benzoic acid

CAS Registry Number®

2280-89-9

CAS Name

3-Amino-2,4,6-triiodo-5-[(methylamino)carbonyl]benzoic acid

Molecular Formula

C9H7I3N2O3

Molecular Mass

571.88

Cite this Page

3-Amino-2,4,6-triiodo-5-[(methylamino)carbonyl]benzoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=2280-89-9 (retrieved 2024-11-24) (CAS RN: 2280-89-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    266-268 °C

Source(s)

Other Names and Identifiers

InChI

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

InChIKey

InChIKey=AKXKBAWZIVNNJR-UHFFFAOYSA-N

SMILES

C(NC)(=O)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(C(=O)NC)=C1I

Other Names for this Substance

  • Benzoic acid, 3-amino-2,4,6-triiodo-5-[(methylamino)carbonyl]-
  • Isophthalamic acid, 5-amino-2,4,6-triiodo-N-methyl-
  • 3-Amino-2,4,6-triiodo-5-[(methylamino)carbonyl]benzoic acid
  • 5-Amino-2,4,6-triiodo-N-methylisophthalamic acid
  • 3-Amino-2,4,6-triiodo-5-(methylcarbamoyl)benzoic acid

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