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The molecular formula is C9H8O5.
Some synonyms include 2-(1,3-benzodioxol-5-yloxy)acetic acid, (Benzo[1,3]dioxol-5-yloxy)-acetic acid, and 2-(Benzo[d][1,3]dioxol-5-yloxy)acetic acid.
The computed IUPAC name is 2-(1,3-benzodioxol-5-yloxy)acetic acid.
The InChI is InChI=1S/C9H8O5/c10-9(11)4-12-6-1-2-7-8(3-6)14-5-13-7/h1-3H,4-5H2,(H,10,11).
The InChIKey is OHPMDIAHFMBXQX-UHFFFAOYSA-N.
The canonical SMILES is C1OC2=C(O1)C=C(C=C2)OCC(=O)O.
The molecular weight is 196.16 g/mol.
The XLogP3 value is 1.2.
The hydrogen bond donor count is 1.
The hydrogen bond acceptor count is 5.
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