157911-56-3 Purity
97%
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The molecular formula of 4-Bromo-2-morpholinobenzoic acid is C11H12BrNO3.
The molecular weight of 4-Bromo-2-morpholinobenzoic acid is 286.12 g/mol.
The IUPAC name of 4-Bromo-2-morpholinobenzoic acid is 4-bromo-2-morpholin-4-ylbenzoic acid.
The InChI of 4-Bromo-2-morpholinobenzoic acid is InChI=1S/C11H12BrNO3/c12-8-1-2-9(11(14)15)10(7-8)13-3-5-16-6-4-13/h1-2,7H,3-6H2,(H,14,15).
The InChIKey of 4-Bromo-2-morpholinobenzoic acid is FYELNCRQYNFNFO-UHFFFAOYSA-N.
The canonical SMILES of 4-Bromo-2-morpholinobenzoic acid is C1COCCN1C2=C(C=CC(=C2)Br)C(=O)O.
The CAS number of 4-Bromo-2-morpholinobenzoic acid is 1099687-03-2.
The DSSTox Substance ID of 4-Bromo-2-morpholinobenzoic acid is DTXSID30655926.
Yes, 4-Bromo-2-morpholinobenzoic acid is a canonicalized compound.