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3-Nitrophthalic acid

ALDRICH/369306 - 95%

CAS Number: 603-11-2
Empirical Formula (Hill Notation): C8H5NO6
Molecular Weight: 211.13
EC Number: 210-030-8
MDL Number: MFCD00007138
Linear Formula: O2NC6H3-1,2-(CO2H)2
Product Type: Chemical
Catalog Number PKG Qty. Price Quantity
45-369306-100G 100 g
 $61.10
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This image depicts SKU: 369306-100G

 

assay 95%
InChI 1S/C8H5NO6/c10-7(11)4-2-1-3-5(9(14)15)6(4)8(12)13/h1-3H,(H,10,11)(H,12,13)
InChI key KFIRODWJCYBBHY-UHFFFAOYSA-N
mp 210 °C (dec.) (lit.)
SMILES string OC(=O)c1cccc(c1C(O)=O)[N+]([O-])=O
solubility water: soluble 5%, clear to slightly hazy, colorless to faintly yellow
Application: 3-Nitrophthalic acid may be used as starting reagent in the synthesis of modified 2-iodoxybenzoic acid derivatives. It may be used in the synthesis of brucinium 2-carboxy-6-nitrophthalate dihydrate (systematic name: 2,3-dimethoxy-10-oxostrychnidinium 2-carboxy-6-nitrophthalate dihydrate), via heating with brucine.
General description: 3-Nitrophthalic acid is a degradation product of isoxaben herbicide.It acts as ligand and forms rare-earth complexes with La, Nd, Eu, Tb, Er and Y. Preparation of 3-nitrophthalic acid has been reported.
Packaging: 100 g in poly bottle
Purity 95%
mp 210 °C (dec.) (lit.)
UNSPSC 12352100

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