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CS-W001157 4
Total: USD 88.00

8-Chlorotheophylline

  • CAS No. 85-18-7

  • Cat. No. CS-W014919
  • Molecule weight214.61
  • Purity≥95%
  • MDL No.MFCD00005581

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

8-Chlorotheophylline|CS-W014919

Structure of 85-18-7

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General Information

  • CAS No. 85-18-7
  • Cat. No. CS-W014919
  • Purity ≥95%
  • MDL No. MFCD00005581
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₇ClN₄O₂
  • Molecular Weight 214.61
  • Synonym(s) None
  • SMILES O=C(N1C)N(C)C2=C(NC(Cl)=N2)C1=O

Description

Nickel oxide (NiO) is primarily used in the electronic, optoelectronics, and polymeric industries because of its excellent optical, magnetic, thermal, and mechanical properties. In the semiconductor industry, NiO is used as a p-type intrinsic semiconductor due to its wide bandgap and good chemical stability.Nickel oxide (NiO) is an attractive material because of its many applications in photocatalysis, batteries, capacitor-inductor devices, micro-supercapacitors, electrochromic, and chemical or temperature sensing devices. It can also be used as a conversion reaction-based anode material for lithium-ion batteries due to its low cost, nontoxicity, and high theoretical ability of ~718 mAh/g. In perovskite solar cells (PSCs), NiO is commonly used as a hole transport material because of its excellent band alignment and thermal/chemical compatibility with PSCs to enhance the power conversion efficiency of the device.

Synthesis

  • Route1

    References

    • Chemische Berichte, , vol. 63, p. 2876,2877
  • Route2
    • 1,3-Dimethyl-8-nitro-1H-purine-2,6(3H,9H)-dione|CS-W013045
      2099-73-2
    • ~59%
    • 8-Chlorotheophylline|CS-W014919
      85-18-7

    References

    • Mosselhi; Pfleiderer Journal of Heterocyclic Chemistry, 1993 , vol. 30, # 5 p. 1221 - 1228
  • Route3
    • null|null
      148122-86-5
    • ~99%
    • 8-Chlorotheophylline|CS-W014919
      85-18-7

    References

    • Kuz'menko; Zvolinskaya Chemistry of Heterocyclic Compounds, 2000 , vol. 36, # 8 p. 963 - 970

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
Precautionary Statements : P264-P270-P330-P501

Quality Control

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Computational Chemistry Data

  • TPSA   72.68
  • LogP   -0.3863
  • H_Acceptors   5
  • H_Donors   1
  • Rotatable_Bonds   0

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