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Home Deuterated Building Blocks 192441-86-4
192441-86-4,MFCD01568499
Catalog No.:AA002FVS

192441-86-4 | Benzoic acid, 3-nitro-4-(1-piperazinyl)-, methyl ester

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
97%
in stock  
$122.00   $85.00
- +
1g
97%
in stock  
$228.00   $159.00
- +
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Technical Information
Catalog Number:
AA002FVS
Chemical Name:
Benzoic acid, 3-nitro-4-(1-piperazinyl)-, methyl ester
CAS Number:
192441-86-4
Molecular Formula:
C12H15N3O4
Molecular Weight:
265.2652
MDL Number:
MFCD01568499
SMILES:
COC(=O)c1ccc(c(c1)[N+](=O)[O-])N1CCNCC1
Properties
Computed Properties
 
Complexity:
338  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
3  
XLogP3:
1.1  

Literature
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Additional Info:
SDS
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Tags:192441-86-4 Molecular Formula|192441-86-4 MDL|192441-86-4 SMILES|192441-86-4 Benzoic acid, 3-nitro-4-(1-piperazinyl)-, methyl ester