Home Amines 179555-12-5
179555-12-5,MFCD18803290
Catalog No.:AA01AU9Q

179555-12-5 | Methyl 6-amino-4-methylnicotinate

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1g
97%
in stock  
$288.00   $202.00
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2.5g
97%
in stock  
$654.00   $458.00
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
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  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA01AU9Q
Chemical Name:
Methyl 6-amino-4-methylnicotinate
CAS Number:
179555-12-5
Molecular Formula:
C8H10N2O2
Molecular Weight:
166.1772
MDL Number:
MFCD18803290
SMILES:
COC(=O)c1cnc(cc1C)N
Properties
Computed Properties
 
Complexity:
172  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
2  
XLogP3:
0.7  

Downstream Synthesis Route

[1]CurrentPatentAssignee:MERCK&COINC-US5972975,1999,A

[1]Locationinpatent:experimentalpartWatterson,ScottH.;Xiao,Zili;Dodd,DharmpalS.;Tortolani,DavidR.;Vaccaro,Wayne;Potin,Dominique;Launay,Michele;Stetsko,DawnK.;Skala,Stacey;Davis,PatricM.;Lee,Deborah;Yang,Xiaoxia;McIntyre,KimW.;Balimane,Praveen;Patel,Karishma;Yang,Zheng;Marathe,Punit;Kadiyala,Pathanjali;Tebben,AndrewJ.;Sheriff,Steven;Chang,ChiehyingY.;Ziemba,Theresa;Zhang,Huiping;Chen,Bang-Chi;Delmonte,AlbertJ.;Aranibar,Nelly;McKinnon,Murray;Barrish,JoelC.;Suchard,SuzanneJ.;MuraliDhar[JournalofMedicinalChemistry,2010,vol.53,#9,p.3814-3830]

[2]CurrentPatentAssignee:BEHNKEDIRK;Novartis(w/oSandoz);NOVARTISAG-WO2011/73316,2011,A1Locationinpatent:Page/Pagecolumn66

[3]Yamaguchi,Ryohei;Kobayashi,Daiki;Shimizu,Mineyuki;Fujita,Ken-ichi[JournalofOrganometallicChemistry,2017,vol.843,p.14-19]

[4]CurrentPatentAssignee:SHANGHAIJEMINCAREPHARMACEUTICALS;SHANGHAIJEMINCAREPHARMACEUTICAL;JIANGXIJEMINCAREGROUPCOLTD-WO2022/111581,2022,A1Locationinpatent:Page/Pagecolumn19-20

[1]Patent:WO2011/73316,2011,A1

[2]JournalofOrganometallicChemistry,2017,vol.843,p.14-19

Literature
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SDS
Tags:179555-12-5 Molecular Formula|179555-12-5 MDL|179555-12-5 SMILES|179555-12-5 Methyl 6-amino-4-methylnicotinate