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CS-W001157 4
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Methyl 2-amino-5-chloronicotinate

  • CAS No. 50735-33-6

  • Cat. No. CS-0042671
  • Purity≥98%
  • MDL No.MFCD09031678

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

Methyl 2-amino-5-chloronicotinate|CS-0042671

Structure of 50735-33-6

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General Information

  • CAS No. 50735-33-6
  • Cat. No. CS-0042671
  • Purity ≥98%
  • MDL No. MFCD09031678
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₇ClN₂O₂
  • Molecular Weight 186.60
  • Synonym(s) 2-AMINO-5-CHLORO-NICOTINIC ACID METHYL ESTER
  • SMILES O=C(OC)C1=C(N)N=CC(Cl)=C1

Synthesis

  • Route1

    References

    • SCHERING CORPORATION; PHARMACOPEIA DRUG DISCOVERY, INC. Patent: WO2006/88837 A2, 2006 ; Location in patent: Page/Page column 120 ; WO 2006/088837 A2
  • Route2

    References

    • Becker, Daniel P.; Flynn, Daniel L.; Moormann, Alan E.; Nosal, Roger; Villamil, Clara I.; Loeffler, Richard; Gullikson, Gary W.; Moummi, Chafiq; Yang, Dai-C. Journal of Medicinal Chemistry, 2006 , vol. 49, # 3 p. 1125 - 1139
  • Route3

    References

    • Becker, Daniel P.; Flynn, Daniel L.; Moormann, Alan E.; Nosal, Roger; Villamil, Clara I.; Loeffler, Richard; Gullikson, Gary W.; Moummi, Chafiq; Yang, Dai-C. Journal of Medicinal Chemistry, 2006 , vol. 49, # 3 p. 1125 - 1139

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

Quality Control

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Computational Chemistry Data

  • TPSA   65.21
  • LogP   1.1038
  • H_Acceptors   4
  • H_Donors   1
  • Rotatable_Bonds   1

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