2-Methyl-3-nitrobenzoic acid

Synonym
Product Category
Product Code
CAS Number
MDL Number
Pubchem CID
Reaxys RN
3-Nitro-o-toluic acid
Non-Fluorochemicals, API & Intermediates
KUMI0F997
1975-50-4

PubChem ID

Reax
MFCD00007160

PubChem ID
16096
2050096
image-155171-Trimethyl(trifluoromethyl)silane_reagent.png
Chemical Name
Molecular Formula
Molecular Weight
Assay
Appearance
Melting Point
Packaging
Storage
2-Methyl-3-nitrobenzoic acid
C8H7NO4
181.15
≥98%
White to Yellow Solid
182-184°C
10g,25g,50g,100g,250g,500g,1kg and 25kg
Store at room temperature
2-Methyl-3-nitrobenzoic acid (also known as 3-Nitro-o-toluic acid) was used as starting reagent in the synthesis of methyl 2-methyl-3-nitrobenzoate and 2,3-unsubstituted indoles. Currently it can be used as an intermediate for the preparation of PF-00835231, which is a potent inhibitor of coronavirus 3CL proteases or the potential therapeutic treatment of COVID-19.
Palladium-catalyzed coupling of 2-bromoanilines with vinylstannanes. [1]
Synthesis of (2S)-2-amino-3-(1H-4-indolyl) propanoic acid, a novel tryptophan analog for structural modification of bioactive peptides. [2]
Discovery of Ketone-Based Covalent Inhibitors of Coronavirus 3CL Proteases for the Potential Therapeutic Treatment of COVID-19. [3]
References:
[1] M.E.Krolski, et al, J. Org. Chem., 1988, 53(6), pp 1170-1176.
[2] A.H.Fauq, et al, Tetrahedron, 1998, 9(23), pp 4127-4134.
[3] R.L.Hoffman, et al, J. Med. Chem., 2020, XXXX, XXX, XXX-XXX.
Signal Word
Hazard Statements
Precautionary Statements
HS Code
RIDADR
Legal Information
Not regulated
 
 
29163990
NONH for all modes of transport

1. Product Specification
2. Safety Data Sheet
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