588702-63-0 Purity
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Specification
The molecular formula of Methyl 3,5-dibromo-4-pyridinecarboxylate is C7H5Br2NO2.
The synonyms for Methyl 3,5-dibromo-4-pyridinecarboxylate include Methyl 3,5-dibromoisonicotinate and methyl 3,5-dibromopyridine-4-carboxylate.
The molecular weight of Methyl 3,5-dibromo-4-pyridinecarboxylate is 294.93 g/mol.
The IUPAC name of Methyl 3,5-dibromo-4-pyridinecarboxylate is methyl 3,5-dibromopyridine-4-carboxylate.
The InChI of Methyl 3,5-dibromo-4-pyridinecarboxylate is InChI=1S/C7H5Br2NO2/c1-12-7(11)6-4(8)2-10-3-5(6)9/h2-3H,1H3.
The InChIKey of Methyl 3,5-dibromo-4-pyridinecarboxylate is OTAPIZRUTJEJPF-UHFFFAOYSA-N.
The canonical SMILES of Methyl 3,5-dibromo-4-pyridinecarboxylate is COC(=O)C1=C(C=NC=C1Br)Br.
The XLogP3-AA value of Methyl 3,5-dibromo-4-pyridinecarboxylate is 2.1.
Methyl 3,5-dibromo-4-pyridinecarboxylate has 0 hydrogen bond donor count.
Methyl 3,5-dibromo-4-pyridinecarboxylate has 2 rotatable bond counts.