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69195-96-6,MFCD04972448
Catalog No.:AA006B8B

69195-96-6 | 5-Nitro-1-(phenylmethyl)-1h-imidazole-4-carboxylic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
100mg
95%
in stock  
$368.00   $258.00
- +
250mg
95%
in stock  
$682.00   $478.00
- +
1g
97%
in stock  
$1,729.00   $1,210.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA006B8B
Chemical Name:
5-Nitro-1-(phenylmethyl)-1h-imidazole-4-carboxylic acid
CAS Number:
69195-96-6
Molecular Formula:
C11H9N3O4
Molecular Weight:
247.2069
MDL Number:
MFCD04972448
SMILES:
[O-][N+](=O)c1n(cnc1C(=O)O)Cc1ccccc1
Properties
Properties
 
BP:
522.165 °C at 760 mmHg  
Storage:
2-8℃;Keep in dry area;  

Computed Properties
 
Complexity:
325  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
3  
XLogP3:
1.6  

Downstream Synthesis Route

[1]Chen,Bang-Chi;Chao,SamT.;Sundeen,JosephE.;Tellew,John;Ahmad,Saleem[TetrahedronLetters,2002,vol.43,#9,p.1595-1596]

Literature
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Additional Info:
SDS
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Tags:69195-96-6 Molecular Formula|69195-96-6 MDL|69195-96-6 SMILES|69195-96-6 5-Nitro-1-(phenylmethyl)-1h-imidazole-4-carboxylic acid