| Identification | More | [Name]
3,5-Dihdyroxyphenylacetic acid | [CAS]
4670-09-1 | [Synonyms]
3,5-Dihdyroxyphenylacetic acid
3,5-DIHYDROXY BENZENEACETIC ACID
3,5-DIHYDROXYPHENYLACETIC ACID
3,5-Dihydroxy
3,5-Dihydroxylphenylacetic acid | [Molecular Formula]
C8H8O4 | [MDL Number]
MFCD03428543 | [Molecular Weight]
168.15 | [MOL File]
4670-09-1.mol |
| Chemical Properties | Back Directory | [Melting point ]
126-127 °C | [Boiling point ]
416.1±14.0 °C(Predicted) | [density ]
1.478±0.06 g/cm3(Predicted) | [storage temp. ]
Sealed in dry,Room Temperature | [pka]
4.12±0.10(Predicted) | [InChI]
InChI=1S/C8H8O4/c9-6-1-5(3-8(11)12)2-7(10)4-6/h1-2,4,9-10H,3H2,(H,11,12) | [InChIKey]
IOVOJJDSFSXJQN-UHFFFAOYSA-N | [SMILES]
C1(CC(O)=O)=CC(O)=CC(O)=C1 | [CAS DataBase Reference]
4670-09-1(CAS DataBase Reference) |
| Hazard Information | Back Directory | [Uses]
3,5-Dihydroxyphenyl Acetic Acid is involved in the discovery of KLS-13019, a cannabidiol-derived neuroprotective agent. A major metabolite of myricetin. | [Definition]
ChEBI: (3,5-dihydroxyphenyl)acetic acid is a monocarboxylic acid that is phenylacetic acid carrying two hydroxy substituents at positions 3 and 5 on the benzene ring. It has a role as a drug metabolite. It is a monocarboxylic acid, a member of resorcinols and a member of phenylacetic acids. It is functionally related to a phenylacetic acid. It is a conjugate acid of a (3,5-dihydroxyphenyl)acetate. |
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