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3,4-Dinitrobenzoic acid

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3,4-Dinitrobenzoic acid Basic information

Product Name:
3,4-Dinitrobenzoic acid
Synonyms:
  • LABOTEST-BB LT00455432
  • 3,4-DINITROBENZOIC ACID
  • RARECHEM AL BO 0260
  • 3,4-DINITROBENZOIC ACID OEKANAL, 250 MG
  • 3,4-Dinitrobenzoic acid 99%
  • 3,4-Dinitrobenzoic acid,99%
  • 1-Carboxy-3,4-dinitrobenzene
  • 3,4-Dinitrobenzoic acid, 99% 5GR
CAS:
528-45-0
MF:
C7H4N2O6
MW:
212.12
EINECS:
208-433-9
Product Categories:
  • AromaticsVolatiles/ Semivolatiles
  • Chemical Class
  • D
  • DAlphabetic
  • DID - DINAnalytical Standards
  • Food&Beverage Standards
  • Benzoic acid
  • Alpha Sort
  • Analytical Standards
  • Nitro CompoundsChromatography
  • Organic Acids
Mol File:
528-45-0.mol
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3,4-Dinitrobenzoic acid Chemical Properties

Melting point:
163-166 °C
Boiling point:
351.93°C (rough estimate)
Density 
1.7333 (rough estimate)
refractive index 
1.5300 (estimate)
pka
pK1:2.82 (25°C)
color 
Light orange to Yellow to Green
Water Solubility 
6.7g/L(25 ºC)
Merck 
14,3275
BRN 
2055333
CAS DataBase Reference
528-45-0(CAS DataBase Reference)
EPA Substance Registry System
Benzoic acid, 3,4-dinitro- (528-45-0)
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Safety Information

Hazard Codes 
Xn,Xi
Risk Statements 
36/37/38-20/21/22
Safety Statements 
36/37/39-26-37/39
WGK Germany 
3
RTECS 
DG9140650
Hazard Note 
Irritant
TSCA 
Yes
HS Code 
29163990

MSDS

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3,4-Dinitrobenzoic acid Usage And Synthesis

Chemical Properties

yellowish crystals or crystalline powder

Uses

3,4-Dinitrobenzoic Acid, is used for the synthesis of more complex compounds such as metabolites of Brimonidine (B677520). It is also a specific substrate of glutathione S-transferase (GST), that can be used for the enzyme imaging and studies. It is an important corrosion inhibitor and is also used in photography.

Purification Methods

Crystallise the acid from EtOH by addition of water. [Beilstein 9 III 1778, 9 IV 1242.]

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