| CAS Number: 105174-97-8 ethyl 3-bromoisoxazole-5-carboxylate |
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| General Information | ||||||
| Product Number: 105174978
CAS Registry Number: 105174-97-8
Name:
5-Isoxazolecarboxylic acid, 3-bromo-, ethyl ester
3-Bromo-5-(ethoxycarbonyl)isoxazole; Ethyl 3-bromoisoxazole-5-carboxylate
Chemical Formula: C6H6BrNO3
Exact Mass: 218.95
Molecular Weight: 220.02
m/z: 218.95 (100.0%), 220.95 (97.3%), 221.95 (6.7%), 219.96 (6.7%)
Elemental Analysis: C, 32.75; H, 2.75; Br, 36.32; N, 6.37; O, 21.82
InChI: InChI=1S/C6H6BrNO3/c1-2-10-6(9)4-3-5(7)8-11-4/h3H,2H2,1H3
InChIKey: BLFWSORQDIUISI-UHFFFAOYSA-N
Canonical SMILES : CCOC(=O)C1=CC(=NO1)Br
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Specification |
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98% |
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| References | ||||||
PCT Int. Appl. (2013), WO 2013110643 A1 20130801. PCT Int. Appl. (2010), WO 2010094126 A1 20100826. |
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