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Reference substances

Reference substances

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General information

Inventory

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Reference substance information

IUPAC name:
aluminium(3+) 5-oxo-1-(4-sulfophenyl)-4-[2-(4-sulfophenyl)diazen-1-yl]-4,5-dihydro-1H-pyrazole-3-carboxylic acid

Molecular and structural information

Molecular formula:
C16H12AlN4O9S2
Molecular weight:
495.39
SMILES notation:
[Al+3].OC(=O)C1=NN(C(=O)C1N=NC1=CC=C(C=C1)S(O)(=O)=O)C1=CC=C(C=C1)S(O)(=O)=O
InChl:
InChI=1/C16H12N4O9S2.Al/c21-15-13(18-17-9-1-5-11(6-2-9)30(24,25)26)14(16(22)23)19-20(15)10-3-7-12(8-4-10)31(27,28)29;/h1-8,13H,(H,22,23)(H,24,25,26)(H,27,28,29);/q;+3
Structural formula:
Chemical structure