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6-tert-Butylpyridine-3-carbonitrile

  • CAS No. 56029-45-9

  • Cat. No. CS-0071871
  • Purity≥98%
  • MDL No.MFCD11845758

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

6-tert-Butylpyridine-3-carbonitrile|CS-0071871

Structure of 56029-45-9

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General Information

  • CAS No. 56029-45-9
  • Cat. No. CS-0071871
  • Purity ≥98%
  • MDL No. MFCD11845758
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₁₂N₂
  • Molecular Weight 160.22
  • Synonym(s) 3-Pyridinecarbonitrile, 6-(1,1-dimethylethyl)-
  • SMILES N#CC1=CN=C(C=C1)C(C)(C)C

Synthesis

  • Route1
    • null|null
      100-54-9
    • In-stock
      Pivalic acid|CS-D1464
      75-98-9
    • ~%
    • In-stock
      6-tert-Butylpyridine-3-carbonitrile|CS-0071871
      56029-45-9

    References

    • ASTRAZENECA AB Patent: WO2007/73303 A2, 2007 ; Location in patent: Page/Page column 35 ; WO 2007/073303 A2
  • Route2
    • null|null
      100-54-9
    • null|null
      594-19-4
    • ~%
    • In-stock
      6-tert-Butylpyridine-3-carbonitrile|CS-0071871
      56029-45-9

    References

    • ARENA PHARMACEUTICALS, INC. Patent: WO2005/7658 A2, 2005 ; Location in patent: Page 229 ; WO 2005/007658 A2

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS05,GHS06
Signal Word : Danger
UN#: 3439
Class : 6.1
Packing Group : Ⅲ
Hazard Statements : H301-H312-H315-H318-H332-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   36.68
  • LogP   2.25078
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   0

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