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CAS Number: 22921-67-1
5-acetamido-2-bromobenzoic acid

Structure

 5-acetamido-2-bromobenzoic acid
Name: 5-acetamido-2-bromobenzoic acid
Synonyms:
General Information
Product Number: 22921671

CAS Registry Number 22921-67-1
Name:
Benzoic acid, 5-?(acetylamino)?-?2-?bromo-
Benzoic acid, 5-acetamido-2-bromo- (8CI)
5-(Acetylamino)-2-bromobenzoic acid
5-Acetamido-2-bromobenzoic acid

 

Chemical Formula: C9H8BrNO3
Exact Mass: 256.97
Molecular Weight: 258.07
m/z: 256.97 (100.0%), 258.97 (97.9%), 257.97 (10.2%), 259.97 (9.7%), 260.97 (1.1%)

 

InChI:InChI=1S/C9H8BrNO3/c1-5(12)11-6-2-3-8(10)7(4-6)9(13)14/h2-4H,1H3,(H,11,12)(H,13,14)

InChI Key:JUWQEPVNDAKOQG-UHFFFAOYSA-N

Canonical SMILES:CC(=O)NC1=CC(=C(C=C1)Br)C(=O)O

Specification

98%
References

PCT Int. Appl. (2012), WO 2012145581 A1 20121026.

PCT Int. Appl. (2012), WO 2012108455 A1 20120816.
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