3-(Acetylamino)-5-[(acetylamino)methyl]-2,4,6-triiodobenzoic acid
CAS Registry Number®
440-58-4
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CAS Name
3-(Acetylamino)-5-[(acetylamino)methyl]-2,4,6-triiodobenzoic acidMolecular Formula
C12H11I3N2O4Molecular Mass
627.94Cite this Page
3-(Acetylamino)-5-[(acetylamino)methyl]-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=440-58-4 (retrieved ) (CAS RN: 440-58-4). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Melting Point (1)
255 °C
Source(s)
- (1) PhysProp data were obtained from Syracuse Research Corporation of Syracuse, New York (US)
Other Names and Identifiers
InChI
InChI=1S/C12H11I3N2O4/c1-4(18)16-3-6-8(13)7(12(20)21)10(15)11(9(6)14)17-5(2)19/h3H2,1-2H3,(H,16,18)(H,17,19)(H,20,21)
InChIKey
InChIKey=VVDGWALACJEJKG-UHFFFAOYSA-N
SMILES
N(C(C)=O)C1=C(I)C(C(O)=O)=C(I)C(CNC(C)=O)=C1I
Canonical SMILES
O=C(O)C1=C(I)C(NC(=O)C)=C(I)C(=C1I)CNC(=O)C
Other Names for this Substance
- Benzoic acid, 3-(acetylamino)-5-[(acetylamino)methyl]-2,4,6-triiodo-
- m-Toluic acid, α,5-diacetamido-2,4,6-triiodo-
- 3-(Acetylamino)-5-[(acetylamino)methyl]-2,4,6-triiodobenzoic acid
- 3-Acetamido-5-acetamidomethyl-2,4,6-triiodobenzoic acid
- Iodamide
