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CAS Number: 1246554-99-3
2-(2-bromothiazol-5-yl)acetonitrile

Structure

2-(2-bromothiazol-5-yl)acetonitrile
Name: 2-(2-bromothiazol-5-yl)acetonitrile
Synonyms:
General Information
Product Number: 1246554993
CAS Registry Number: 1246554-99-3
Name:
        5-​Thiazoleacetonitrile​, 2-​bromo-
        2-​(2-​Bromothiazol-​5-​yl)​acetonitrile 
 
Chemical Formula: C5H3BrN2S
Exact Mass: 201.92
Molecular Weight: 203.06
m/z: 203.92 (100.0%), 201.92 (98.1%), 204.92 (6.9%), 202.92 (6.8%), 205.91 (4.3%)
Elemental Analysis: C, 29.57; H, 1.49; Br, 39.35; N, 13.80; S, 15.79
 
InChI: InChI=1S/C5H3BrN2S/c6-5-8-3-4(9-5)1-2-7/h3H,1H2
InChIKey: BYQSYJDHZJUGLI-UHFFFAOYSA-N
Canonical SMILES : C1=C(SC(=N1)Br)CC#N

Specification

98%

References

PCT Int. Appl. (2011), WO 2011133888 A1 20111027.                                  

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