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Substance Name: 1,3-Benzenedicarboxylic acid, 5-nitro-, 1-ethyl ester
RN: 22871-55-2
InChIKey: HOYHBDFTELAGGG-UHFFFAOYSA-N

Molecular Formula

  • C10-H9-N-O6

Molecular Weight

  • 239.182
 
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Names and Synonyms

Synonyms

  • 5-Nitroisophthalic acid, monoethyl ester
  • EINECS 245-273-9
  • Monoethyl 5-nitroisophthalate

Systematic Names

  • 1,3-Benzenedicarboxylic acid, 5-nitro-, 1-ethyl ester
  • 1,3-Benzenedicarboxylic acid, 5-nitro-, monoethyl ester
  • Ethyl hydrogen 5-nitroisophthalate

Registry Numbers

CAS Registry Number

  • 22871-55-2

System Generated Number

  • 0022871552

Structure Descriptors

InChI

1S/C10H9NO6/c1-2-17-10(14)7-3-6(9(12)13)4-8(5-7)11(15)16/h3-5H,2H2,1H3,(H,12,13)

InChIKey

HOYHBDFTELAGGG-UHFFFAOYSA-N

Smiles

O=C(OCC)c1cc([N+]([O-])=O)cc(C(O)=O)c1