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CAS Number: 552331-06-3
6-bromo-3-chloroisoquinoline

Structure

6-bromo-3-chloroisoquinoline
Name: 6-bromo-3-chloroisoquinoline
Synonyms:
General Information
Product Number: 552331063
CAS Registry Number: 552331-06-3
Name:
        Isoquinoline, 6-​bromo-​3-​chloro-
        6-​Bromo-​3-​chloroisoquinoline 
 
Chemical Formula: C9H5BrClN
Exact Mass: 240.93
Molecular Weight: 242.50
m/z: 242.93 (100.0%), 240.93 (77.4%), 244.92 (24.1%), 243.93 (9.8%), 241.93 (7.8%), 245.93 (2.4%)
Elemental Analysis: C, 44.58; H, 2.08; Br, 32.95; Cl, 14.62; N, 5.78
 
InChI: InChI=1S/C9H5BrClN/c10-8-2-1-6-5-12-9(11)4-7(6)3-8/h1-5H
InChIKey: HYCCUWZOOADPGN-UHFFFAOYSA-N
Canonical SMILES : C1=CC2=CN=C(C=C2C=C1Br)Cl

Specification

98%

References

PCT Int. Appl. (2014), WO 2014037751 A1 20140313.                                  

PCT Int. Appl. (2013), WO 2013185103 A1 20131212.

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