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Substance Name: 1H-Pyrazole-3,4-dicarboxylic acid, 1-(3-methylphenyl)-5-(4-bromophenyl)-
RN: 96734-63-3
InChIKey: AFXGBNQPJCLAOC-UHFFFAOYSA-N

Molecular Formula

  • C18-H13-Br-B2-O4

Molecular Weight

  • 401.215
 
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Names and Synonyms

  • 1H-Pyrazole-3,4-dicarboxylic acid, 1-(3-methylphenyl)-5-(4-bromophenyl)-

Registry Numbers

CAS Registry Number

  • 96734-63-3

System Generated Number

  • 0096734633

Structure Descriptors

InChI

1S/C18H13BrN2O4/c1-10-3-2-4-13(9-10)21-16(11-5-7-12(19)8-6-11)14(17(22)23)15(20-21)18(24)25/h2-9H,1H3,(H,22,23)(H,24,25)

InChIKey

AFXGBNQPJCLAOC-UHFFFAOYSA-N

Smiles

n1(nc(c(c1c1ccc(cc1)Br)C(=O)O)C(=O)O)c1cc(ccc1)C