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588685-93-2,MFCD03423432
Catalog No.:AA00EE80

588685-93-2 | 5-(4,5-Dimethylthien-3-yl)-4-methyl-4h-1,2,4-triazole-3-thiol

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Purity
Availability
Price(USD)
Quantity
  
1g
95%
in stock  
$172.00   $120.00
- +
5g
95%
in stock  
$685.00   $479.00
- +
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Technical Information
Catalog Number:
AA00EE80
Chemical Name:
5-(4,5-Dimethylthien-3-yl)-4-methyl-4h-1,2,4-triazole-3-thiol
CAS Number:
588685-93-2
Molecular Formula:
C9H11N3S2
Molecular Weight:
225.3337
MDL Number:
MFCD03423432
SMILES:
Cc1scc(c1C)c1nnc(n1C)S
Properties
Computed Properties
 
Complexity:
290  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
1  
XLogP3:
2.1  

Literature
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Additional Info:
SDS
Tags:588685-93-2 Molecular Formula|588685-93-2 MDL|588685-93-2 SMILES|588685-93-2 5-(4,5-Dimethylthien-3-yl)-4-methyl-4h-1,2,4-triazole-3-thiol