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CS-W001157 4
Total: USD 88.00

Cyclohexane-1,2,3,4,5,6-hexaone

  • CAS No. 527-31-1

  • Cat. No. CS-0077184
  • Purity≥98%
  • MDL No.MFCD00149075

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

Cyclohexane-1,2,3,4,5,6-hexaone|CS-0077184

Structure of 527-31-1

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General Information

  • CAS No. 527-31-1
  • Cat. No. CS-0077184
  • Purity ≥98%
  • MDL No. MFCD00149075
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₆O₆
  • Molecular Weight 168.06
  • Synonym(s) Trquinoyl
  • SMILES O=C1C(C(C(C(C1=O)=O)=O)=O)=O

Description

Hexaketocyclohexane octahydrate has been used in the preparation of hexaazatriphenylenehexacarbonitrile.

Synthesis

  • Route1

    References

    • Naddaka, V. I.; Avanesyan, K. V.; Cherkinskaya, M. L. Journal of Organic Chemistry USSR (English Translation), 1990 , vol. 26, # 4 p. 705 - 711 Zhurnal Organicheskoi Khimii, 1990 , vol. 26, # 4 p. 823 - 830
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    References

    • Iraci, G.; Back, M. H. Canadian Journal of Chemistry, 1988 , vol. 66, p. 1293 - 1294

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H312-H332
Precautionary Statements : P261-P271-P280-P302+P352-P304+P340-P362+P364-P501

Quality Control

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Computational Chemistry Data

  • TPSA   102.42
  • LogP   -2.5854
  • H_Acceptors   6
  • H_Donors   0
  • Rotatable_Bonds   0

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