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Home Nitro Compounds 77359-11-6
77359-11-6,MFCD00191556
Catalog No.:AA003LSL

77359-11-6 | Mono-4-nitrobenzyl malonate

Pack Size
Purity
Availability
Price(USD)
Quantity
  
5g
97%
in stock  
$8.00   $6.00
- +
10g
97%
in stock  
$11.00   $8.00
- +
25g
97%
in stock  
$18.00   $13.00
- +
100g
97%
in stock  
$56.00   $39.00
- +
500g
97%
in stock  
$140.00   $98.00
- +
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA003LSL
Chemical Name:
Mono-4-nitrobenzyl malonate
CAS Number:
77359-11-6
Molecular Formula:
C10H9NO6
Molecular Weight:
239.1816
MDL Number:
MFCD00191556
SMILES:
OC(=O)CC(=O)OCc1ccc(cc1)[N+](=O)[O-]
Properties
Properties
 
BP:
455.8°C at 760 mmHg  
Form:
Solid  
MP:
109 °C  
Storage:
Keep in dry area;Room Temperature;  

Computed Properties
 
Complexity:
302  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
5  
XLogP3:
1.4  

Upstream Synthesis Route

[1]BioorganicandMedicinalChemistryLetters,2015,vol.25,#21,p.4933-4936

[2]Tetrahedron,2001,vol.57,#9,p.1837-1847

[3]TetrahedronLetters,2003,vol.44,#40,p.7499-7502

[1]Patent:US5516934,1996,A,

[1]Patent:US5087734,1992,A,

[1]Patent:US4576746,1986,A,

Downstream Synthesis Route
29556-37-4    77359-11-6   
C46H68N2O34 

[1]ChemistryLetters,1994,p.167-170

[1]JournalofMedicinalChemistry,1989,vol.32,p.357-367

[1]AgriculturalandBiologicalChemistry,1986,vol.50,p.2352-2356

Literature
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SDS
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Tags:77359-11-6 Molecular Formula|77359-11-6 MDL|77359-11-6 SMILES|77359-11-6 Mono-4-nitrobenzyl malonate |Organic_Building_Blocks