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

CAS Registry Number®

1206-91-3
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CAS Name

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

Molecular Formula

C9H8I3NO2

Molecular Mass

542.88

Cite this Page

3-Amino-2,4,6-triiodobenzenepropanoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1206-91-3 (retrieved 2024-05-18) (CAS RN: 1206-91-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    233 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C9H8I3NO2/c10-5-3-6(11)9(13)8(12)4(5)1-2-7(14)15/h3H,1-2,13H2,(H,14,15)

InChIKey

InChIKey=BVDHMFVGWNGIQE-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

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

Other Names for this Substance

  • Benzenepropanoic acid, 3-amino-2,4,6-triiodo-
  • Hydrocinnamic acid, 3-amino-2,4,6-triiodo-
  • 3-Amino-2,4,6-triiodobenzenepropanoic acid
  • β-(3-Amino-2,4,6-triiodophenyl)propionic acid
  • Iodobilimin acid

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