2,4,6-triiodo-3-aminobenzoic acid[2,4,6-三碘-3-氨基苯甲酸]

3119-15-1

CAS Name

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

Molecular Formula

C₇H₄I₃NO₂

Molecular Mass

514.83

Compound Properties

• Melting Point (1)

  190-192 °C (decomp)

Source(s)

• (1) Priewe, Hans; Chemische Berichte, (1954), 87, 651-8, CAplus

Other Names and Identifiers

InChI

InChI=1S/C7H4I3NO2/c8-2-1-3(9)6(11)5(10)4(2)7(12)13/h1H,11H2,(H,12,13)

InChIKey

InChIKey=QMQFFHSJUJDRPG-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

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

Other Names for this Substance