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5-Chloro-3,4-dihydroquinolin-2(1H)-one

  • CAS No. 72995-15-4

  • Cat. No. CS-0529222
  • Molecule weight181.62
  • Purity≥98%
  • MDL No.None

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

5-Chloro-3,4-dihydroquinolin-2(1H)-one|CS-0529222

Structure of 72995-15-4

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General Information

  • CAS No. 72995-15-4
  • Cat. No. CS-0529222
  • Purity ≥98%
  • MDL No. None
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₈ClNO
  • Molecular Weight 181.62
  • Synonym(s) 5-chloro-3,4-dihydro-2(1H)-quinolinone
  • SMILES O=C1NC2=C(C(Cl)=CC=C2)CC1

Synthesis

  • Route1

    References

    • Otsuka Pharmaceutical Co., Ltd. Patent: US4416884 A1, 1983 ;
  • Route2
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      1247021-83-5
    • ~%
    • In-stock
      5-Chloro-3,4-dihydroquinolin-2(1H)-one|CS-0529222
      72995-15-4

    References

    • MERCK SHARP and DOHME CORP.; ElexoPharm GmbH; HOYT, Scott, B.; PETRILLI, Whitney Lane; LONDON, Clare; XIONG, Yusheng; TAYLOR, Jerry Andrew; ALI, Amjad; LO, Michael; HENDERSON, Timothy, J.; HU, Qingzhong; HARTMANN, Rolf; YIN, Lina; HEIM, Ralf; BEY, Emmanuel; SAXENA, Rohit; SAMANTA, Swapan Kumar; KULKARNI, Bheemashankar, A. Patent: WO2012/148808 A1, 2012 ; Location in patent: Page/Page column 138 ; WO 2012/148808 A1
  • Route3

    References

    • MERCK SHARP and DOHME CORP.; ElexoPharm GmbH; HOYT, Scott, B.; PETRILLI, Whitney Lane; LONDON, Clare; XIONG, Yusheng; TAYLOR, Jerry Andrew; ALI, Amjad; LO, Michael; HENDERSON, Timothy, J.; HU, Qingzhong; HARTMANN, Rolf; YIN, Lina; HEIM, Ralf; BEY, Emmanuel; SAXENA, Rohit; SAMANTA, Swapan Kumar; KULKARNI, Bheemashankar, A. Patent: WO2012/148808 A1, 2012 ; WO 2012/148808 A1

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-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

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Computational Chemistry Data

  • TPSA   29.1
  • LogP   2.2247
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   0

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