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Home Amines 1206724-39-1
1206724-39-1,MFCD28962778
Catalog No.:AA00HFHN

1206724-39-1 | Ethyl 4-(butylamino)-3-nitrobenzoate

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
98%
in stock  
$211.00   $148.00
- +
5g
98%
in stock  
$610.00   $427.00
- +
10g
98%
in stock  
$1,009.00   $706.00
- +
25g
98%
in stock  
$1,808.00   $1,266.00
- +
  • Technical Information
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  • Technical Information
  • Properties
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Technical Information
Catalog Number:
AA00HFHN
Chemical Name:
Ethyl 4-(butylamino)-3-nitrobenzoate
CAS Number:
1206724-39-1
Molecular Formula:
C13H18N2O4
Molecular Weight:
266.2930
MDL Number:
MFCD28962778
SMILES:
CCCCNc1ccc(cc1[N+](=O)[O-])C(=O)OCC
Properties
Computed Properties
 
Complexity:
304  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
7  
XLogP3:
3.8  

Literature

Title: Ethyl 4-butyl-amino-3-nitro-benzoate.

Journal: Acta crystallographica. Section E, Structure reports online 20090901

Title: 4-Butyl-amino-3-nitro-benzoic acid.

Journal: Acta crystallographica. Section E, Structure reports online 20090501

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SDS
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Tags:1206724-39-1 Molecular Formula|1206724-39-1 MDL|1206724-39-1 SMILES|1206724-39-1 Ethyl 4-(butylamino)-3-nitrobenzoate