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Substance Name: 4-Hydroxyisophthalic acid, compound with 1,2-dihydro-1,5-dimethyl-2-phenyl-3H-pyrazol-3-one
RN: 71700-98-6
InChIKey: LJGNXFFZAGIPAA-UHFFFAOYSA-N

Molecular Formula

  • C11-H12-N2-O.x-C8-H6-O5

Molecular Weight

  • 370.3592
 
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Names and Synonyms

Synonym

  • EINECS 275-854-2

Systematic Name

  • 4-Hydroxyisophthalic acid, compound with 1,2-dihydro-1,5-dimethyl-2-phenyl-3H-pyrazol-3-one

Registry Numbers

CAS Registry Number

  • 71700-98-6

System Generated Number

  • 0071700986

Molecular Formulas

Molecular Formula

  • C11-H12-N2-O.x-C8-H6-O5

Molecular Formula Fragments

  • C11-H12-N2-O
  • C8-H6-O5
  • COMPONENT

Structure Descriptors

InChI

1S/C11H12N2O.C8H6O5/c1-9-8-11(14)13(12(9)2)10-6-4-3-5-7-10;9-6-2-1-4(7(10)11)3-5(6)8(12)13/h3-8H,1-2H3;1-3,9H,(H,10,11)(H,12,13)

InChIKey

LJGNXFFZAGIPAA-UHFFFAOYSA-N

Smiles

Cc1cc(=O)n(n1C)c2ccccc2.c1cc(c(cc1C(=O)O)C(=O)O)O