| CAS Number: 91182-60-4 5-(4-bromophenyl)-3-methylisoxazole-4-carboxylic acid |
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| General Information | ||||||
| Product Number: 91182604
CAS Registry Number:
91182-60-4
Name:
4-Isoxazolecarboxylic acid, 5-(4-bromophenyl)-3-methyl-
4-Isoxazolecarboxylic acid, 5-(p-bromophenyl)-3-methyl- (7CI); 5-(4-Bromophenyl)-3-methylisoxazole-4-carboxylic acid
Chemical Formula: C11H8BrNO3
Exact Mass: 280.97
Molecular Weight: 282.09
m/z: 280.97 (100.0%), 282.97 (97.9%), 281.97 (12.4%), 283.97 (11.8%), 284.97 (1.3%)
Elemental Analysis: C, 46.84; H, 2.86; Br, 28.33; N, 4.97; O, 17.02
InChI: InChI=1S/C11H8BrNO3/c1-6-9(11(14)15)10(16-13-6)7-2-4-8(12)5-3-7/h2-5H,1H3,(H,14,15)
InChIKey: GFLKZFOUAHOGJF-UHFFFAOYSA-N
Canonical SMILES : CC1=NOC(=C1C(=O)O)C2=CC=C(C=C2)Br
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Specification |
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98% |
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| References | ||||||
PCT Int. Appl. (2013), WO 2013025733 A1 20130221. PCT Int. Appl. (2012), WO 2012138797 A1 20121011. PCT Int. Appl. (2012), WO 2012078805 A1 20120614. |
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