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The molecular formula is C6H9BrO4.
The molecular weight is 225.04 g/mol.
The IUPAC name is dimethyl (2R)-2-bromobutanedioate.
The InChI is InChI=1S/C6H9BrO4/c1-10-5(8)3-4(7)6(9)11-2/h4H,3H2,1-2H3/t4-/m1/s1.
The InChIKey is RGYMYJITHXYRMA-SCSAIBSYSA-N.
The Canonical SMILES is COC(=O)CC(C(=O)OC)Br.
The CAS number is 99147-12-3.
The XLogP3-AA value is 0.8.
There are 4 hydrogen bond acceptor counts.
Yes, it is a canonicalized compound.
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