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Cat. No. Size / Unit Price Qty
CS-W001157 4
Total: USD 88.00

Musk ketone

  • CAS No. 81-14-1

  • Cat. No. CS-0018535
  • Purity≥98%
  • MDL No.MFCD00024271

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

Musk ketone|CS-0018535

Structure of 81-14-1

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General Information

  • CAS No. 81-14-1
  • Cat. No. CS-0018535
  • Purity ≥98%
  • MDL No. MFCD00024271
  • Storage 4°C, sealed storage, away from moisture
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₄H₁₈N₂O₅
  • Molecular Weight None
  • Synonym(s) None
  • SMILES CC(C1=C(C)C([N+]([O-])=O)=C(C(C)(C)C)C([N+]([O-])=O)=C1C)=O

Synthesis

  • Route1
    • 4'-Tert-Butyl-2',6'-dimethylacetophenone|CS-0763778
      2040-10-0
    • ~68%
    • In-stock
      Musk ketone|CS-0018535
      81-14-1

    References

    • Safaei-Ghomi, Javad; Bamoniri, Abdolhamid Organic Preparations and Procedures International, 2004 , vol. 36, # 2 p. 188 - 191
  • Route2
    • 4'-Tert-Butyl-2',6'-dimethylacetophenone|CS-0763778
      2040-10-0
    • ~39%
    • null|null
      81-15-2
    • In-stock
      Musk ketone|CS-0018535
      81-14-1
    • null|null
      71850-77-6

    References

    • Synthesis, , # 8 p. 1291 - 1293
  • Route3
    • 4'-Tert-Butyl-2',6'-dimethylacetophenone|CS-0763778
      2040-10-0
    • ~55%
    • In-stock
      Musk ketone|CS-0018535
      81-14-1
    • null|null
      71850-77-6

    References

    • Synthesis, , # 8 p. 1291 - 1293

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS02,GHS07,GHS08,GHS09
Signal Word : Danger
UN#: 1648
Class : 3
Packing Group : Ⅱ
Hazard Statements : H225-H302-H312-H319-H332-H351-H410
Precautionary Statements : P210-P233-P240-P241-P242-P243-P261-P264-P270-P271-P273-P280-P302+P352-P304+P340-P330-P362+P364-P370+P378-P391-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   103.35
  • LogP   3.61994
  • H_Acceptors   5
  • H_Donors   0
  • Rotatable_Bonds   3

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