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Vanadyl 3,10,17,24-tetra-tert-butyl-1,8,15,22-tetrakis(dimethylamino)-29H,31H-phthalocyanine

  • CAS No. 61114-01-0

  • Cat. No. CS-0181440
  • Purity≥98%
  • MDL No.None

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

Vanadyl 3,10,17,24-tetra-tert-butyl-1,8,15,22-tetrakis(dimethylamino)-29H,31H-phthalocyanine|CS-0181440

Structure of 61114-01-0

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General Information

  • CAS No. 61114-01-0
  • Cat. No. CS-0181440
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₅₆H₆₈N₁₂OV
  • Molecular Weight 976.16
  • Synonym(s) vanadyl tetra-T-butyl-tetrakis(dimethyl-amino)-29
  • SMILES CN(C)C1=CC(C(C)(C)C)=CC2=C(N3[V]4=O)/N=C5N=C(C6=CC(C(C)(C)C)=CC(N(C)C)=C\56)/N=C7C8=C(C=C(C=C8N(C)C)C(C)(C)C)/C(N4/7)=N/C(C9=C/%10C=C(C=C9N(C)C)C(C)(C)C)=NC%10=N/C3=C21

Synthesis

  • Route1
    • null|null
      61109-18-0
    • null|null
      7718-98-1
    • ~33%
    • Vanadyl 3,10,17,24-tetra-tert-butyl-1,8,15,22-tetrakis(dimethylamino)-29H,31H-phthalocyanine|CS-0181440
      61114-01-0

    References

    • Mikhalenko, S. A.; Derkacheva, V. M.; Luk'yanets, E. A. Journal of General Chemistry USSR (English Translation), 1981 , vol. 51, p. 1405 - 1411 Zhurnal Obshchei Khimii, 1981 , vol. 51, p. 1650 - 1656

Safety Information

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

Quality Control

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Computational Chemistry Data

  • TPSA   114.05
  • LogP   10.1835
  • H_Acceptors   13
  • H_Donors   0
  • Rotatable_Bonds   4

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