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CAS Number: 162252-45-1
4-acetamido-3-hydroxy-5-nitrobenzoic acid

Structure

4-acetamido-3-hydroxy-5-nitrobenzoic acid
Name: 4-acetamido-3-hydroxy-5-nitrobenzoic acid
Synonyms:
General Information
Product Number: 162252451

CAS Registry Number 162252-45-1
Name:
Benzoic acid, 4-?(acetylamino)?-?3-?hydroxy-?5-?nitro-
4-(Acetylamino)-3-hydroxy-5-nitrobenzoic acid
BANA 105

 

Chemical Formula: C9H8N2O6
Exact Mass: 240.04
Molecular Weight: 240.17
m/z: 240.04 (100.0%), 241.04 (10.8%), 242.04 (1.7%)

 

InChI:InChI=1S/C9H8N2O6/c1-4(12)10-8-6(11(16)17)2-5(9(14)15)3-7(8)13/h2-3,13H,1H3,(H,10,12)(H,14,15)

InChI Key:JIDRTCHFBHJIDG-UHFFFAOYSA-N

Canonical SMILES:CC(=O)NC1=C(C=C(C=C1O)C(=O)O)[N+](=O)[O-]

Specification

98%

References

PCT Int. Appl. (1996), WO 9639838 A1 19961219.                                  

U.S. (1995), US 5453533 A 19950926. 

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