866546-07-8 Purity
96%
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The molecular formula is C12H10BrNO2S.
The PubChem CID is 824466.
The IUPAC name is ethyl 4-(4-bromophenyl)-1,3-thiazole-2-carboxylate.
The InChI is InChI=1S/C12H10BrNO2S/c1-2-16-12(15)11-14-10(7-17-11)8-3-5-9(13)6-4-8/h3-7H,2H2,1H3.
The InChIKey is XGCLHKIDYQWOAC-UHFFFAOYSA-N.
The synonyms are 53101-02-3, ETHYL 4-(4-BROMOPHENYL)THIAZOLE-2-CARBOXYLATE, 2-Thiazolecarboxylic acid, 4-(4-bromophenyl)-, ethyl ester, ethyl 4-(4-bromophenyl)-1,3-thiazole-2-carboxylate, ETHYL 4-(4-BROMOPHENYL)-2-THIAZOLE CARBOXYLATE.
The molecular weight is 312.18 g/mol.
The CAS number is 53101-02-3.
The XLogP3-AA value is 3.9.
Yes, Ethyl 4-(4-bromophenyl)thiazole-2-carboxylate is canonicalized according to PubChem.