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Home Other Building Blocks 58952-03-7
58952-03-7,MFCD06738326
Catalog No.:AA00E9X6

58952-03-7 | 3,4-Dimethylbenzothioamide

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Purity
Availability
Price(USD)
Quantity
  
1g
97%
in stock  
$215.00   $150.00
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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:
AA00E9X6
Chemical Name:
3,4-Dimethylbenzothioamide
CAS Number:
58952-03-7
Molecular Formula:
C9H11NS
Molecular Weight:
165.2553
MDL Number:
MFCD06738326
SMILES:
NC(=S)c1ccc(c(c1)C)C
Properties
Computed Properties
 
Complexity:
156  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
1  
XLogP3:
2.7  

Downstream Synthesis Route

[1]JournalofMedicinalChemistry,1995,vol.38,p.353-358

Literature
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SDS
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Tags:58952-03-7 Molecular Formula|58952-03-7 MDL|58952-03-7 SMILES|58952-03-7 3,4-Dimethylbenzothioamide