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306934-96-3,MFCD02682027
Catalog No.:AA0030RB

306934-96-3 | 5-(Thiophen-2-yl)nicotinic acid

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Purity
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1g
97%
in stock  
$145.00   $102.00
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5g
97%
in stock  
$544.00   $381.00
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA0030RB
Chemical Name:
5-(Thiophen-2-yl)nicotinic acid
CAS Number:
306934-96-3
Molecular Formula:
C10H7NO2S
Molecular Weight:
205.2331
MDL Number:
MFCD02682027
SMILES:
OC(=O)c1cncc(c1)c1cccs1
Properties
Properties
 
BP:
423.8 °C at 760 mmHg  
Form:
Solid  
Storage:
Room Temperature;  

Computed Properties
 
Complexity:
222  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
2  
XLogP3:
1.7  

Downstream Synthesis Route
924645-92-1    306934-96-3   
5-(thiophen-2-yl)-nicotinicacid1-methyl-2-(4-pyrimidin-2-yl-piperazin-1-yl)-ethyl-amide 

[1]CurrentPatentAssignee:ROCHEHOLDINGAG-US2007/37974,2007,A1Locationinpatent:Page/Pagecolumn24

[1]Choi,Yongmun;Syeda,Farisa;Walker,JohnR.;FinertyJr.,PatrickJ.;Cuerrier,Dominic;Wojciechowski,Amy;Liu,Qingsong;Dhe-Paganon,Sirano;Gray,NathanaelS.[BioorganicandMedicinalChemistryLetters,2009,vol.19,#15,p.4467-4470]

[2]Arimitsu,Kenji;Furukawa,Takenori;Kawashima,Hidekazu;Kimura,Hiroyuki;Torimoto,Hanae;Yagi,Yusuke;Yasui,Hiroyuki[ACSMedicinalChemistryLetters,2021,vol.12,#8,p.1238-1244]

[1]Locationinpatent:experimentalpartBlackburn,Christopher;Duffey,MatthewO.;Gould,AlexandraE.;Kulkarni,Bheemashankar;Liu,JaneX.;Menon,Saurabh;Nagayoshi,Masayuki;Vos,TriciaJ.;Williams,Juliet[BioorganicandMedicinalChemistryLetters,2010,vol.20,#16,p.4795-4799]

Literature
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SDS
Tags:306934-96-3 Molecular Formula|306934-96-3 MDL|306934-96-3 SMILES|306934-96-3 5-(Thiophen-2-yl)nicotinic acid