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CAS Number: 889858-12-2
tert-butyl 4-bromo-2-fluorobenzoate

Structure

 tert-butyl 4-bromo-2-fluorobenzoate
Name: tert-butyl 4-bromo-2-fluorobenzoate
Synonyms:
General Information
Product Number: 889858122

CAS Registry Number 889858-12-2
Name:
Benzoic acid, 4-?bromo-?2-?fluoro-?, 1,?1-?dimethylethyl ester
2-Methylpropan-2-yl 4-bromo-2-fluorobenzoate
tert-Butyl 4-bromo-2-fluorobenzoate

 

Chemical Formula: C11H12BrFO2
Exact Mass: 274.00
Molecular Weight: 275.11
m/z: 274.00 (100.0%), 276.00 (97.7%), 275.00 (12.0%), 277.00 (11.8%)

 

InChI:InChI=1S/C11H12BrFO2/c1-11(2,3)15-10(14)8-5-4-7(12)6-9(8)13/h4-6H,1-3H3

InChI Key:ZPGZHSAOCVWZMR-UHFFFAOYSA-N

Canonical SMILES:CC(C)(C)OC(=O)C1=C(C=C(C=C1)Br)F

Specification

98%
References

PCT Int. Appl. (2016), WO 2016102482 A1 20160630.                                  

PCT Int. Appl. (2016), WO 2016097004 A1 20160623.                                 
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