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Chemical structure of 4-Methoxyphenylacetic Acid

GC34193

4-Methoxyphenylacetic Acid

Also listed as 2-(4-Methoxyphenyl)acetic acid (4-Methoxyphenylacetic acid)

2-(4-Methoxyphenyl)acetic acid (4-Methoxyphenylacetic acid) is a plasma metabolite, with high sensitivity and specificity value as a biomarker for discriminating between NSCLC and healthy controls

ChemicalCAS104-01-8MW166.17FormulaC9H10O3
CAS number
104-01-8
Molecular weight
166.17
Formula
C9H10O3
Solubility
Soluble in DMSO
InChIKey
NRPFNQUDKRYCNX-UHFFFAOYSA-N
Catalogue number
GC34193
Brand
GLPBIO
Computed properties PubChem CID 7690 · XLogP 1.4 · TPSA 46.5 Ų · H-bond donors 1
XLogP
1.4
TPSA
46.5 Ų
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
12

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

Computed descriptors from PubChem (CID 7690), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

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