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CS-W001157 4
Total: USD 88.00

4,4-Dimethyl-1,2,3,4-tetrahydroisoquinoline

  • CAS No. 78592-91-3

  • Cat. No. CS-0071036
  • Molecule weight161.24
  • Purity≥97%
  • MDL No.MFCD08234528

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

4,4-Dimethyl-1,2,3,4-tetrahydroisoquinoline|CS-0071036

Structure of 78592-91-3

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General Information

  • CAS No. 78592-91-3
  • Cat. No. CS-0071036
  • Purity ≥97%
  • MDL No. MFCD08234528
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₅N
  • Molecular Weight 161.24
  • Synonym(s) 4,4-dimethyl-1,2,3,4-tetrahydro-isoquinoline
  • SMILES CC1(C)C(C=CC=C2)=C2CNC1

Synthesis

  • Route1
    • null|null
      6600-22-2
    • ~72%
    • 4,4-Dimethyl-1,2,3,4-tetrahydroisoquinoline|CS-0071036
      78592-91-3

    References

    • SmithKline Beecham p.l.c. Patent: US6358974 B1, 2002 ;
  • Route2

    References

    • US2005/267018 A1, ; US 20050267018 A1
  • Route3
    • null|null
      68003-61-2
    • ~%
    • 4,4-Dimethyl-1,2,3,4-tetrahydroisoquinoline|CS-0071036
      78592-91-3

    References

    • Journal of Organic Chemistry, , vol. 48, # 26 p. 5348 - 5354

Safety Information

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GHS Pictogram : N/A
GHS No : N/A
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UN#: N/A
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Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

Quality Control

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Computational Chemistry Data

  • TPSA   12.03
  • LogP   2.0674
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   0

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