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866038-40-6,MFCD04125566
Catalog No.:AA00IPDN

866038-40-6 | (2E)-2-[(E)-benzoyl]-3-[4-(2-chloroacetyl)-1H-pyrrol-2-yl]prop-2-enenitrile

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1mg
>90%
1 week  
$299.00   $209.00
- +
5mg
>90%
1 week  
$319.00   $223.00
- +
10mg
>90%
1 week  
$358.00   $250.00
- +
500mg
>90%
1 week  
$1,087.00   $761.00
- +
1g
>90%
1 week  
$1,960.00   $1,372.00
- +
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Technical Information
Catalog Number:
AA00IPDN
Chemical Name:
(2E)-2-[(E)-benzoyl]-3-[4-(2-chloroacetyl)-1H-pyrrol-2-yl]prop-2-enenitrile
CAS Number:
866038-40-6
Molecular Formula:
C16H11ClN2O2
Molecular Weight:
298.7237
MDL Number:
MFCD04125566
SMILES:
N#C/C(=C\c1[nH]cc(c1)C(=O)CCl)/C(=O)c1ccccc1
Properties
Computed Properties
 
Complexity:
486  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
5  
Undefined Bond Stereocenter Count:
1  
XLogP3:
2.7  

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Additional Info:
SDS
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Tags:866038-40-6 Molecular Formula|866038-40-6 MDL|866038-40-6 SMILES|866038-40-6 (2E)-2-[(E)-benzoyl]-3-[4-(2-chloroacetyl)-1H-pyrrol-2-yl]prop-2-enenitrile