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4,4-Dimethyl-3,4-dihydro-1H-quinolin-2-one

  • CAS No. 76693-04-4

  • Cat. No. CS-0340819
  • Molecule weight175.23
  • Purity≥98%
  • MDL No.None

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

4,4-Dimethyl-3,4-dihydro-1H-quinolin-2-one|CS-0340819

Structure of 76693-04-4

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General Information

  • CAS No. 76693-04-4
  • Cat. No. CS-0340819
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₃NO
  • Molecular Weight 175.23
  • Synonym(s) 4,4-dimethyl-3,4-dihydroquinolin-2(1H)-one
  • SMILES CC1(CC(NC2=CC=CC=C21)=O)C

Synthesis

  • Route1
    • 3-Methyl-N-phenylbut-2-enamide|CS-0561184
      13209-80-8
    • ~99%
    • In-stock
      4,4-Dimethyl-3,4-dihydro-1H-quinolin-2-one|CS-0340819
      76693-04-4

    References

    • NEUROCRINE BIOSCIENCES, INC. Patent: WO2008/124614 A1, 2008 ; Location in patent: Page/Page column 41 ; WO 2008/124614 A1
  • Route2

    References

    • US2011/98311 A1, ;
  • Route3
    • null|null
      3350-78-5
    • ~%
    • In-stock
      4,4-Dimethyl-3,4-dihydro-1H-quinolin-2-one|CS-0340819
      76693-04-4

    References

    • Journal of the Chinese Chemical Society, , vol. 47, # 1 p. 155 - 162

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS05,GHS07
Signal Word : Danger
UN#: 1759
Class : 8
Packing Group : Ⅲ
Hazard Statements : H227-H314-H335
Precautionary Statements : P210-P260-P261-P264-P271-P280-P301+P330+P331-P303+P361+P353-P304+P340-P305+P351+P338-P363-P370+P378-P403-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   29.1
  • LogP   2.3064
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   0

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