Home Nitro Compounds 58123-66-3
58123-66-3,MFCD12173027
Catalog No.:AA00IA9O

58123-66-3 | 3-Methanesulfonyl-5-nitrobenzoic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
100mg
95%
1 week  
$179.00   $126.00
- +
250mg
95%
1 week  
$303.00   $212.00
- +
1g
95%
1 week  
$816.00   $571.00
- +
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Technical Information
Catalog Number:
AA00IA9O
Chemical Name:
3-Methanesulfonyl-5-nitrobenzoic acid
CAS Number:
58123-66-3
Molecular Formula:
C8H7NO6S
Molecular Weight:
245.2093
MDL Number:
MFCD12173027
SMILES:
OC(=O)c1cc(cc(c1)S(=O)(=O)C)[N+](=O)[O-]
Properties
Computed Properties
 
Complexity:
392  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
2  
XLogP3:
0.5  

Literature
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Additional Info:
SDS
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Tags:58123-66-3 Molecular Formula|58123-66-3 MDL|58123-66-3 SMILES|58123-66-3 3-Methanesulfonyl-5-nitrobenzoic acid