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CAS Number: 1329119-36-9
3,4-diamino-5-bromobenzoic acid

Structure

 3,4-diamino-5-bromobenzoic acid
Name: 3,4-diamino-5-bromobenzoic acid
Synonyms:
General Information
Product Number: 1329119369

CAS Registry Number 1329119-36-9
Name:
Benzoic acid, 3,?4-?diamino-?5-?bromo-

 

Chemical Formula: C7H7BrN2O2
Exact Mass: 229.97
Molecular Weight: 231.05
m/z: 229.97 (100.0%), 231.97 (97.7%), 230.97 (8.4%), 232.97 (7.5%)

 

InChI:InChI=1S/C7H7BrN2O2/c8-4-1-3(7(11)12)2-5(9)6(4)10/h1-2H,9-10H2,(H,11,12)

InChI Key:HWUDRTKCFMUMNO-UHFFFAOYSA-N

Canonical SMILES:C1=C(C=C(C(=C1N)N)Br)C(=O)O

Specification

98%
References

PCT Int. Appl. (2011), WO 2011099832 A2 20110818.                                  
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