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110893-37-3,MFCD19981536
Catalog No.:AA00835Z

110893-37-3 | Isopropyl 3-cyanobenzoate

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
98%
in stock  
$211.00   $148.00
- +
5g
98%
in stock  
$776.00   $544.00
- +
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Technical Information
Catalog Number:
AA00835Z
Chemical Name:
Isopropyl 3-cyanobenzoate
CAS Number:
110893-37-3
Molecular Formula:
C11H11NO2
Molecular Weight:
189.2105
MDL Number:
MFCD19981536
SMILES:
N#Cc1cccc(c1)C(=O)OC(C)C
Properties
Computed Properties
 
Complexity:
251  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Rotatable Bond Count:
3  
XLogP3:
2.6  

Literature
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Additional Info:
SDS
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Tags:110893-37-3 Molecular Formula|110893-37-3 MDL|110893-37-3 SMILES|110893-37-3 Isopropyl 3-cyanobenzoate