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Chemical structure of 3,5-Dimethoxyphenol

GC60498

3,5-Dimethoxyphenol

Also known as 3,5-dimethoxyphenol

3,5-Dimethoxyphenol is a toxin metabolite, found in human consuming yew leaves

ChemicalCAS500-99-2MW154.16FormulaC8H10O3
CAS number
500-99-2
Molecular weight
154.16
Formula
C8H10O3
Solubility
DMSO ： 100 mg/mL (648·68 mM; Need ultrasonic)
InChIKey
XQDNFAMOIPNVES-UHFFFAOYSA-N
Catalogue number
GC60498
Brand
GLPBIO
Computed properties PubChem CID 10383 · XLogP 1.6 · TPSA 38.7 Ų · H-bond donors 1
XLogP
1.6
TPSA
38.7 Ų
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
11

SMILES COC1=CC(=CC(=C1)O)OC

Computed descriptors from PubChem (CID 10383), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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