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Specification
The molecular formula of 2-(3-Bromophenoxy)propanoic acid is C9H9BrO3.
The molecular weight of 2-(3-Bromophenoxy)propanoic acid is 245.07 g/mol.
The IUPAC name of 2-(3-Bromophenoxy)propanoic acid is 2-(3-bromophenoxy)propanoic acid.
The InChI of 2-(3-Bromophenoxy)propanoic acid is InChI=1S/C9H9BrO3/c1-6(9(11)12)13-8-4-2-3-7(10)5-8/h2-6H,1H3,(H,11,12).
The InChIKey of 2-(3-Bromophenoxy)propanoic acid is CVTUTWGZPGJAQL-UHFFFAOYSA-N.
The canonical SMILES of 2-(3-Bromophenoxy)propanoic acid is CC(C(=O)O)OC1=CC(=CC=C1)Br.
The CAS number of 2-(3-Bromophenoxy)propanoic acid is 41183-67-9.
The XLogP3 value of 2-(3-Bromophenoxy)propanoic acid is 2.4.
The hydrogen bond donor count of 2-(3-Bromophenoxy)propanoic acid is 1.
The hydrogen bond acceptor count of 2-(3-Bromophenoxy)propanoic acid is 3.