4'-Hydroxymethylazoxybenzene-4-carboxylic acid

AlkaPlorer ID: AK279079

Synonym: 4-[(4-(Hydroxymethyl)phenyl]-ONN-azoxy]benzoic acid 

IUPAC Name: (4-carboxyphenyl)imino-[4-(hydroxymethyl)phenyl]-oxidoazanium

Structure

SMILES: O=C(O)C1=CC=C(N=[N+]([O-])C2=CC=C(CO)C=C2)C=C1

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InChI: InChI=1S/C14H12N2O4/c17-9-10-1-7-13(8-2-10)16(20)15-12-5-3-11(4-6-12)14(18)19/h1-8,17H,9H2,(H,18,19)

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InChIKey: DMYQJTAVDSDDCV-UHFFFAOYSA-N

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Source

Properties Information

Molecule Weight: 272.26

TPSA: 95.96

MolLogP: 2.8028000000000004

Number of H-Donors: 2

Number of H-Acceptors: 4

RingCount: 2

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information