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88891-75-2,MFCD05662462
Catalog No.:AA0049LP

88891-75-2 | Pyrimidine-5-carbothioic acid amide

Pack Size
Purity
Availability
Price(USD)
Quantity
  
100mg
≥ 99% (Assay)
in stock  
$212.00   $148.00
- +
250mg
≥ 99% (Assay)
in stock  
$379.00   $265.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
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  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA0049LP
Chemical Name:
Pyrimidine-5-carbothioic acid amide
CAS Number:
88891-75-2
Molecular Formula:
C5H5N3S
Molecular Weight:
139.1783
MDL Number:
MFCD05662462
SMILES:
NC(=S)c1cncnc1
Properties
Properties
 
Form:
Solid  
MP:
170-170.5℃ (ethanol )  
Storage:
Keep in dry area;2-8℃;  

Computed Properties
 
Complexity:
109  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
1  
XLogP3:
-0.3  

Downstream Synthesis Route
5344-90-1    88891-75-2   
2-(pyrimidin-5-yl)-4H-benzod1,3thiazine 

[1]Putta,V.P.RamaKishore;Gujjarappa,Raghuram;Tyagi,Ujjawal;Pujar,PrasadP.;Malakar,ChandiC.[OrganicandBiomolecularChemistry,2019,vol.17,#9,p.2516-2528]

Literature
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SDS
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