Home Categories 3,4-Dihydroxy-5-nitrobenzoicAcid
A4600356

3,4-Dihydroxy-5-nitrobenzoicAcid , 95% , 84211-30-3

CAS NO.:84211-30-3

Empirical Formula: C7H5NO6

Molecular Weight: 199.12

MDL number: MFCD00872080

Pack Size Price Stock Quantity
250mg RMB215.20 In Stock
1g RMB543.20 In Stock
5g RMB1919.20 In Stock
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Update time: 2022-07-08

PRODUCT Properties

Melting point: >222oC (dec.)
Boiling point: 411.1±45.0 °C(Predicted)
Density  1.799±0.06 g/cm3(Predicted)
storage temp.  Hygroscopic, -20°C Freezer, Under inert atmosphere
solubility  DMSO (Slightly), Methanol (Slightly)
form  Solid
pka 3.82±0.10(Predicted)
color  Yellow to Beige
InChI InChI=1S/C7H5NO6/c9-5-2-3(7(11)12)1-4(6(5)10)8(13)14/h1-2,9-10H,(H,11,12)
InChIKey HDPSONAKHMNQPA-UHFFFAOYSA-N
SMILES C(O)(=O)C1=CC([N+]([O-])=O)=C(O)C(O)=C1

Description and Uses

3,4-Dihydroxy-5-nitrobenzoic Acid is a useful synthetic intermediate in the synthesis of Entacapone (E558500); a peripherally selective inhibitor of catechol-O-methyltransferase (COMT). Also an antiparkinsonian.

Safety

Symbol(GHS) 
GHS07
Signal word  Warning
Hazard statements  H302-H315-H319-H335
Precautionary statements  P261-P305+P351+P338

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