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Substance Name: Benzoic acid, 4-(1,1-dimethylethyl)-, aluminum salt (3:1)
RN: 4067-14-5
InChIKey: ZGNIGAHODXRWIT-UHFFFAOYSA-K

Molecular Formula

  • C11-H14-O2.1/3Al

Molecular Weight

  • 558.647
 
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Names and Synonyms

Synonyms

  • Benzoic acid, 4-(1,1-dimethylethyl)-, aluminum salt
  • EINECS 223-774-3

Systematic Names

  • Aluminium 4-(1,1-dimethylethyl)benzoate
  • Benzoic acid, 4-(1,1-dimethylethyl)-, aluminum salt
  • Benzoic acid, 4-(1,1-dimethylethyl)-, aluminum salt (3:1)

Registry Numbers

CAS Registry Number

  • 4067-14-5

Other Registry Numbers

  • 172641-15-5
  • 289713-18-4

Related Registry Number

  • 98-73-7 (Parent)

System Generated Number

  • 0004067145

Molecular Formulas

Molecular Formula

  • C11-H14-O2.1/3Al

Molecular Formula Fragments

  • Al
  • C11-H14-O2
  • COMPONENT

Structure Descriptors

InChI

1S/3C11H14O2.Al/c3*1-11(2,3)9-6-4-8(5-7-9)10(12)13;/h3*4-7H,1-3H3,(H,12,13);/q;;;+3/p-3

InChIKey

ZGNIGAHODXRWIT-UHFFFAOYSA-K

Smiles

[O-]C(=O)c1ccc(cc1)C(C)(C)C.[O-]C(=O)c1ccc(C(C)(C)C)cc1.[O-]C(=O)c1ccc(C(C)(C)C)cc1.[Al+3]