Summary

Molecular formula: C8H8O4
SMILES: COc1cc(ccc1O)C(=O)O
InChI: InChI=1S/C8H8O4/c1-12-7-4-5(8(10)11)2-3-6(7)9/h2-4,9H,1H3,(H,10,11)
InChIKey: WKOLLVMJNQIZCI-UHFFFAOYSA-N

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
c1ccccc1

Scaffold Graph/Node level:
C1CCCCC1

Scaffold Graph level:
C1CCCCC1

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Chemical classification

Kingdom: Organic compounds
Super class: Benzenoids
Class: Benzene and substituted derivatives
Sub class: Benzoic acids and derivatives

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Synonymous chemical names:
vanillic acid

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External chemical identifiers:
CID_8468; CAS_121-34-6; CHEMSPIDER_8155; ZINC_ZINC000000338275; Molport_MolPort-000-871-610

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Chemical structure download