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CS-W001157 4
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2,3,4,5-Tetrahydro-1h-1,4-benzodiazepine

  • CAS No. 5946-39-4

  • Cat. No. CS-0126746
  • Molecule weight148.20
  • Purity≥98%
  • MDL No.MFCD03789577

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

2,3,4,5-Tetrahydro-1h-1,4-benzodiazepine|CS-0126746

Structure of 5946-39-4

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General Information

  • CAS No. 5946-39-4
  • Cat. No. CS-0126746
  • Purity ≥98%
  • MDL No. MFCD03789577
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₁₂N₂
  • Molecular Weight 148.20
  • Synonym(s) 2,3,4,5-Tetrahydro-1H-benzo[e][1,4]diazepine
  • SMILES C12=CC=CC=C1NCCNC2

Synthesis

  • Route1
    • null|null
      1086007-30-8
    • ~70%
    • 2,3,4,5-Tetrahydro-1h-1,4-benzodiazepine|CS-0126746
      5946-39-4

    References

    • Topharman Shanghai Co., Ltd.; Weifang Tehua Chemical Co., Ltd. Patent: EP2163538 A1, 2010 ; Location in patent: Page/Page column 7 ;
  • Route2
    • null|null
      1086096-22-1
    • ~70%
    • 2,3,4,5-Tetrahydro-1h-1,4-benzodiazepine|CS-0126746
      5946-39-4

    References

    • TOPHARMAN SHANGHAI CO., LTD.; WEIFANG TEHUA CHEMICAL CO., LTD. Patent: US2010/256358 A1, 2010 ; Location in patent: Page/Page column 4-5 ;
  • Route3

    References

    • Sashida, Haruki; Fujii, Akira; Tsuchiya, Takashi Chemical & Pharmaceutical Bulletin, 1987 , vol. 35, # 8 p. 3182 - 3189

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS05
Signal Word : Danger
UN#: 3259
Class : 8
Packing Group : Ⅲ
Hazard Statements : H314
Precautionary Statements : P260-P264-P280-P301+P330+P331-P304+P340-P363-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   24.06
  • LogP   1.2017
  • H_Acceptors   2
  • H_Donors   2
  • Rotatable_Bonds   0

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