CAS
942920-50-5 Purity
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942920-50-5 Purity
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The molecular formula is C12H9BrO2.
The molecular weight is 265.10 g/mol.
The IUPAC name is methyl 6-bromonaphthalene-2-carboxylate.
The InChI is InChI=1S/C12H9BrO2/c1-15-12(14)10-3-2-9-7-11(13)5-4-8(9)6-10/h2-7H,1H3.
The InChIKey is JEUBRLPXJZOGPX-UHFFFAOYSA-N.
The canonical SMILES is COC(=O)C1=CC2=C(C=C1)C=C(C=C2)Br.
The CAS number is 33626-98-1.
The European Community (EC) number is 608-896-0.
The UNII is 47YX2K4GR3.
The XLogP3-AA value is 3.7.