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Home Other Building Blocks 120069-21-8
120069-21-8,MFCD00051755
Catalog No.:AA000Q62

120069-21-8 | 2-(Isopropylsulfonyl)acetonitrile

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Purity
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Price(USD)
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250mg
in stock  
$121.00   $85.00
- +
1g
in stock  
$247.00   $173.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
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  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA000Q62
Chemical Name:
2-(Isopropylsulfonyl)acetonitrile
CAS Number:
120069-21-8
Molecular Formula:
C5H9NO2S
Molecular Weight:
147.1955
MDL Number:
MFCD00051755
SMILES:
CC(S(=O)(=O)CC#N)C
Properties
Computed Properties
 
Complexity:
213  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
3  
Rotatable Bond Count:
2  
XLogP3:
0.2  

Downstream Synthesis Route
288083-49-8    288083-15-8    120069-21-8   
(Z)-3-(2-Methyl-benzofuran-5-ylamino)-3-(S)-2-oxo-1-(2-oxo-2-pyrrolidin-1-yl-ethyl)-azepan-3-ylamino-2-(propane-2-sulfonyl)-acrylonitrile 

[1]BioorganicandMedicinalChemistryLetters,2005,vol.15,p.5453-5458

[1]BioorganicandMedicinalChemistryLetters,2006,vol.16,p.4686-4691

[2]Patent:US6933299,2005,B1.Locationinpatent:Page/Pagecolumn75

120069-21-8   
NEU-0000379 

[1]BioorganicandMedicinalChemistryLetters,2006,vol.16,p.4686-4691

[1]Patent:US2005/143401,2005,A1.Locationinpatent:Page/Pagecolumn46

120069-21-8    3125-64-2    74-88-4   
2-Isopropylsulfonyl-3-(3-methoxyphenylamino)-3-methylsulfanyl-2-propenenitrile 

[1]Patent:US2001/25111,2001,A1

Literature
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SDS
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Tags:120069-21-8 Molecular Formula|120069-21-8 MDL|120069-21-8 SMILES|120069-21-8 2-(Isopropylsulfonyl)acetonitrile