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Home Other Building Blocks 1094395-94-4
1094395-94-4,MFCD11208552
Catalog No.:AA01C5AG

1094395-94-4 | 3-oxo-2-phenyl-3-(thiophen-3-yl)propanenitrile

Pack Size
Purity
Availability
Price(USD)
Quantity
  
50mg
95%
3 weeks  
$218.00   $153.00
- +
100mg
95%
3 weeks  
$267.00   $187.00
- +
250mg
95%
3 weeks  
$333.00   $233.00
- +
500mg
95%
3 weeks  
$458.00   $320.00
- +
1g
95%
3 weeks  
$554.00   $388.00
- +
2.5g
95%
3 weeks  
$975.00   $683.00
- +
5g
95%
3 weeks  
$1,388.00   $972.00
- +
10g
95%
3 weeks  
$2,004.00   $1,403.00
- +
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Technical Information
Catalog Number:
AA01C5AG
Chemical Name:
3-oxo-2-phenyl-3-(thiophen-3-yl)propanenitrile
CAS Number:
1094395-94-4
Molecular Formula:
C13H9NOS
Molecular Weight:
227.2817
MDL Number:
MFCD11208552
SMILES:
N#CC(C(=O)c1cscc1)c1ccccc1
Properties
Computed Properties
 
Complexity:
300  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Rotatable Bond Count:
3  
Undefined Atom Stereocenter Count:
1  
XLogP3:
2.9  

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Additional Info:
SDS
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Tags:1094395-94-4 Molecular Formula|1094395-94-4 MDL|1094395-94-4 SMILES|1094395-94-4 3-oxo-2-phenyl-3-(thiophen-3-yl)propanenitrile