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104-01-8 | 4-Methoxyphenylacetic acid
CAS No: 104-01-8 Catalog No: AG003LOQ MDL No:MFCD00004345
Product Description
Catalog Number:
AG003LOQ
Chemical Name:
4-Methoxyphenylacetic acid
CAS Number:
104-01-8
Molecular Formula:
C9H10O3
Molecular Weight:
166.1739
MDL Number:
MFCD00004345
IUPAC Name:
2-(4-methoxyphenyl)acetic acid
InChI:
InChI=1S/C9H10O3/c1-12-8-4-2-7(3-5-8)6-9(10)11/h2-5H,6H2,1H3,(H,10,11)
InChI Key:
NRPFNQUDKRYCNX-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)CC(=O)O
EC Number:
203-166-4
UNII:
AJP2V8U5K6
RTECS Number:
AI8960000
UN Number:
3261
Properties
Complexity:
148
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
166.063g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
166.176g/mol
Monoisotopic Mass:
166.063g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
Literature
| Title | Journal |
|---|---|
| Ester and carbamate ester derivatives of Biochanin A: synthesis and in vitro evaluation of estrogenic and antiproliferative activities. | Bioorganic & medicinal chemistry 20120501 |
| Evaluation of (R)-(-)-α-methoxy phenyl acetic acid as a chiral shift reagent for resolution and determination of R and S enantiomers of modafinil in bulk drugs and formulations by 1H NMR spectroscopy. | Chirality 20120401 |
| Biological evaluation of phenolic constituents from the trunk of Berberis koreana. | Bioorganic & medicinal chemistry letters 20110415 |
| 2-(3-Bromo-4-meth-oxy-phen-yl)acetic acid. | Acta crystallographica. Section E, Structure reports online 20100701 |
| Anticancer activity of dinuclear gallium(III) carboxylate complexes. | European journal of medicinal chemistry 20100201 |
| Characterization of pu-erh tea using chemical and metabolic profiling approaches. | Journal of agricultural and food chemistry 20090422 |
| Coenzyme Q0 induces apoptosis and modulates the cell cycle in estrogen receptor negative breast cancer cells. | Anti-cancer drugs 20090101 |
| Study of the cytotoxic activity of di and triphenyltin(IV) carboxylate complexes. | Journal of inorganic biochemistry 20081201 |
| 1-(2-Hydr-oxy-3,4-dimethoxy-phen-yl)-2-(4-methoxy-phen-yl)ethanone. | Acta crystallographica. Section E, Structure reports online 20081201 |
| Lipophilic (hydroxy)phenylacetates by solvent-free lipase-catalyzed esterification and transesterification in vacuo. | Journal of agricultural and food chemistry 20080709 |
| Biotransformation of p-methoxyphenylacetonitrile into p-methoxyphenylacetic acid by resting cells of Bacillus subtilis. | Biotechnology and applied biochemistry 20080701 |
| 15N CIDNP investigations of the peroxynitric acid nitration of L-tyrosine and of related compounds. | Organic & biomolecular chemistry 20060221 |
| Effect of applied potential on arylmethyl films oxidatively grafted to carbon surfaces. | Langmuir : the ACS journal of surfaces and colloids 20051122 |
| Contribution of aldehyde oxidase, xanthine oxidase, and aldehyde dehydrogenase on the oxidation of aromatic aldehydes. | Chemical research in toxicology 20041001 |
| Development and substantiation of a liquid chromatographic method for monitoring organic reactions involved in synthesis of 4-methoxyphenylacetic acid. | Journal of chromatography. A 20021004 |
| Fine structural specificity differences of trimethoprim allergenic determinants. | Clinical and experimental allergy : journal of the British Society for Allergy and Clinical Immunology 19961001 |
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