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361336-72-3,MFCD01566295
Catalog No.:AA00D57V

361336-72-3 | Methyl 5-nitro-2-(phenylthio)benzoate

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
95%
in stock  
$455.00   $319.00
- +
1g
95%
in stock  
$1,063.00   $744.00
- +
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Technical Information
Catalog Number:
AA00D57V
Chemical Name:
Methyl 5-nitro-2-(phenylthio)benzoate
CAS Number:
361336-72-3
Molecular Formula:
C14H11NO4S
Molecular Weight:
289.3064
MDL Number:
MFCD01566295
SMILES:
COC(=O)c1cc(ccc1Sc1ccccc1)[N+](=O)[O-]
Properties
Computed Properties
 
Complexity:
352  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
5  
Rotatable Bond Count:
4  
XLogP3:
3.7  

Literature
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Additional Info:
SDS
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Tags:361336-72-3 Molecular Formula|361336-72-3 MDL|361336-72-3 SMILES|361336-72-3 Methyl 5-nitro-2-(phenylthio)benzoate