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CS-W001157 4
Total: USD 88.00

4,5,6,7-Tetrahydro-1H-indole-2-carbaldehyde

  • CAS No. 80744-01-0

  • Cat. No. CS-0070987
  • Molecule weight149.19
  • Purity≥97%
  • MDL No.MFCD01895566

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

4,5,6,7-Tetrahydro-1H-indole-2-carbaldehyde|CS-0070987

Structure of 80744-01-0

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General Information

  • CAS No. 80744-01-0
  • Cat. No. CS-0070987
  • Purity ≥97%
  • MDL No. MFCD01895566
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₁₁NO
  • Molecular Weight 149.19
  • Synonym(s) 1H-Indole-2-carboxaldehyde, 4,5,6,7-tetrahydro- (9CI)
  • SMILES O=CC1=CC2=C(CCCC2)N1

Synthesis

  • Route1

    References

    • THE JOHNS HOPKINS UNIVERSITY; THE SCRIPPS RESEARCH INSTITUTE; ZACK, Donald, Jeffrey; BANNISTER, Thomas; VOJKOVSKY, Tomas; YANG, Zhiyong; BERLINICKE, Cynthia Patent: WO2011/119777 A2, 2011 ; Location in patent: Page/Page column 35-36 ; WO 2011/119777 A2
  • Route2
    • null|null
      51050-85-2
    • null|null
      68-12-2
    • ~23%
    • null|null
      896712-05-3
    • 4,5,6,7-Tetrahydro-1H-indole-2-carbaldehyde|CS-0070987
      80744-01-0

    References

    • Tetrahedron Letters, , vol. 47, # 22 p. 3693 - 3696
  • Route3
    • null|null
      82826-29-7
    • ~16%
    • 4,5,6,7-Tetrahydro-1H-indole-2-carbaldehyde|CS-0070987
      80744-01-0
    • null|null
      105679-16-1

    References

    • Tetrahedron Letters, , vol. 26, # 50 p. 6183 - 6184

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-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   32.86
  • LogP   1.706
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   1

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