Home Aldehydes 116313-85-0
116313-85-0,MFCD00871897
Catalog No.:AA000C4C

116313-85-0 | 3,4-Dihydroxy-5-nitrobenzaldehyde

Pack Size
Purity
Availability
Price(USD)
Quantity
  
5g
97%
in stock  
$7.00   $5.00
- +
10g
97%
in stock  
$9.00   $7.00
- +
25g
97%
in stock  
$12.00   $8.00
- +
100g
97%
in stock  
$27.00   $19.00
- +
500g
97%
in stock  
$91.00   $64.00
- +
  • Technical Information
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  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA000C4C
Chemical Name:
3,4-Dihydroxy-5-nitrobenzaldehyde
CAS Number:
116313-85-0
Molecular Formula:
C7H5NO5
Molecular Weight:
183.1183
MDL Number:
MFCD00871897
SMILES:
O=Cc1cc(O)c(c(c1)[N+](=O)[O-])O
Properties
Properties
 
BP:
310.9°C at 760 mmHg  
Form:
Solid  
MP:
147 °C  
Storage:
Keep in dry area;Room Temperature;  

Computed Properties
 
Complexity:
213  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Rotatable Bond Count:
1  
XLogP3:
1.1  

Literature

Title: (E)-Ethyl 2-cyano-3-(3,4-dihydr-oxy-5-nitro-phen-yl)acrylate.

Journal: Acta crystallographica. Section E, Structure reports online 20091001

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SDS
Tags:116313-85-0 Molecular Formula|116313-85-0 MDL|116313-85-0 SMILES|116313-85-0 3,4-Dihydroxy-5-nitrobenzaldehyde