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CS-W001157 4
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3,5-Di-tert-butylbenzoic acid

  • CAS No. 16225-26-6

  • Cat. No. CS-W010335
  • Purity≥96%
  • MDL No.MFCD00082727

*For research and further manufacturing use only, not for direct human use.

3,5-Di-tert-butylbenzoic acid|CS-W010335

Structure of 16225-26-6

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General Information

  • CAS No. 16225-26-6
  • Cat. No. CS-W010335
  • Purity ≥96%
  • MDL No. MFCD00082727
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₅H₂₂O₂
  • Molecular Weight 234.34
  • Synonym(s) 3,5-bis(tert-butyl)benzoic acid
  • SMILES O=C(O)C1=CC(C(C)(C)C)=CC(C(C)(C)C)=C1

Description

3,5-Di-tert-butylbenzoic acid was used in the synthesis of 5,5-di-tert-butylanilinium sulphate.

Synthesis

  • Route1

    References

    • Crasovschi, Afanase; Grecu, Nicoleta; Negoita, Nicolae; Caproiu, Miron Teodor; Balaban, Alexandru T. Revue Roumaine de Chimie, 1992 , vol. 37, # 11-12 p. 1335 - 1340
  • Route2
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      108-88-3
    • ~%
    • In-stock
      3,5-Di-tert-butylbenzoic acid|CS-W010335
      16225-26-6

    References

    • Industrial and Engineering Chemistry, , vol. 47, p. 2311
  • Route3
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      72215-86-2
    • ~%
    • In-stock
      3,5-Di-tert-butylbenzoic acid|CS-W010335
      16225-26-6

    References

    • Canadian Journal of Chemistry, , vol. 57, p. 2172 - 2179

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302+H312+H332
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P501

Quality Control

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Computational Chemistry Data

  • TPSA   37.3
  • LogP   3.9798
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   1

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