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CAS Number: 179898-34-1
3-bromo-5-fluorobenzonitrile

Structure

3-bromo-5-fluorobenzonitrile
Name: 3-bromo-5-fluorobenzonitrile
Synonyms:
General Information
Product Number: 179898341

CAS Registry Number 179898-34-1
Name:
Benzonitrile, 3-​bromo-​5-​fluoro-
3-Bromo-5-fluorobenzonitrile
3-Cyano-5-fluoro-1-bromo-benzene
3-Fluoro-5-bromobenzonitrile

 

Chemical Formula: C7H3BrFN
Exact Mass: 198.94
Molecular Weight: 200.01
m/z: 198.94 (100.0%), 200.94 (97.3%), 201.94 (7.7%), 199.95 (7.6%)

 

InChI:InChI=1S/C7H3BrFN/c8-6-1-5(4-10)2-7(9)3-6/h1-3H

InChI Key:IADLVSLZPQYXIF-UHFFFAOYSA-N

Canonical SMILES:C1=C(C=C(C=C1F)Br)C#N

Specification

98%

References

(1) Angus, Derek; Bioorganic & Medicinal Chemistry Letters 2011, V21(1), P271-275 CAPLUS

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