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CAS Number: 654684-13-6
2-hydroxy-6-methyl-3-nitrobenzoic acid

Structure

2-hydroxy-6-methyl-3-nitrobenzoic acid
Name: 2-hydroxy-6-methyl-3-nitrobenzoic acid
Synonyms:
General Information
Product Number: 654684136

CAS Registry Number 654684-13-6
Name:
Benzoic acid, 2-​hydroxy-​6-​methyl-​3-​nitro-
2-Hydroxy-6-methyl-3-nitrobenzoic acid

 

Chemical Formula: C8H7NO5
Exact Mass: 197.03
Molecular Weight: 197.14
m/z: 197.03 (100.0%), 198.04 (8.9%), 199.04 (1.4%)

 

InChI:InChI=1S/C8H7NO5/c1-4-2-3-5(9(13)14)7(10)6(4)8(11)12/h2-3,10H,1H3,(H,11,12)

InChI Key:MZLBVXGCENMMTP-UHFFFAOYSA-N

Canonical SMILES:CC1=C(C(=C(C=C1)[N+](=O)[O-])O)C(=O)O

Specification

98%

References

PCT Int. Appl. (2005), WO 2005066147 A1 20050721.                                 

PCT Int. Appl. (2004), WO 2004033440 A1 20040422.                                 

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