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Substance Name: 1,3-Benzenedicarboxylic acid, 5-(1,1-dimethylethyl)-
RN: 2359-09-3
InChIKey: BJLUCDZIWWSFIB-UHFFFAOYSA-N

Molecular Formula

  • C12-H14-O4

Molecular Weight

  • 222.239
 
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Names and Synonyms

Synonyms

  • 5-tert-Butylisophthalic acid
  • EINECS 219-100-2
  • Isophthalic acid, 5-tert-butyl-

Systematic Names

  • 1,3-Benzenedicarboxylic acid, 5-(1,1-dimethylethyl)-
  • 5-tert-Butylisophthalic acid

Registry Numbers

CAS Registry Number

  • 2359-09-3

Other Registry Number

  • 339064-16-3

System Generated Number

  • 0002359093

Structure Descriptors

InChI

1S/C12H14O4/c1-12(2,3)9-5-7(10(13)14)4-8(6-9)11(15)16/h4-6H,1-3H3,(H,13,14)(H,15,16)

InChIKey

BJLUCDZIWWSFIB-UHFFFAOYSA-N

Smiles

O=C(O)c1cc(cc(C(=O)O)c1)C(C)(C)C