Home Nitro Compounds 22871-55-2
22871-55-2,MFCD00130051
Catalog No.:AA003MUM

22871-55-2 | 5-Nitroisophthalic acid monoethyl ester

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
95%
in stock  
$18.00   $13.00
- +
25g
>98.0%(GC)(T)
in stock  
$36.00   $25.00
- +
500g
>98.0%(GC)(T)
in stock  
$444.00   $311.00
- +
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Technical Information
Catalog Number:
AA003MUM
Chemical Name:
5-Nitroisophthalic acid monoethyl ester
CAS Number:
22871-55-2
Molecular Formula:
C10H9NO6
Molecular Weight:
239.1816
MDL Number:
MFCD00130051
SMILES:
CCOC(=O)c1cc(cc(c1)C(=O)O)[N+](=O)[O-]
Properties
Properties
 
BP:
425.1°C at 760 mmHg  

Computed Properties
 
Complexity:
323  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
4  
XLogP3:
1.9  

Literature
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SDS
Tags:22871-55-2 Molecular Formula|22871-55-2 MDL|22871-55-2 SMILES|22871-55-2 5-Nitroisophthalic acid monoethyl ester