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500-99-2 | 3,5-Dimethoxyphenol
CAS No: 500-99-2 Catalog No: AG003IO1 MDL No:MFCD00008388
Product Description
Catalog Number:
AG003IO1
Chemical Name:
3,5-Dimethoxyphenol
CAS Number:
500-99-2
Molecular Formula:
C8H10O3
Molecular Weight:
154.1632
MDL Number:
MFCD00008388
IUPAC Name:
3,5-dimethoxyphenol
InChI:
InChI=1S/C8H10O3/c1-10-7-3-6(9)4-8(5-7)11-2/h3-5,9H,1-2H3
InChI Key:
XQDNFAMOIPNVES-UHFFFAOYSA-N
SMILES:
COc1cc(OC)cc(c1)O
EC Number:
207-917-7
UNII:
23UXW8136A
NSC Number:
70955
Properties
Complexity:
104
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
154.063g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
154.165g/mol
Monoisotopic Mass:
154.063g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
38.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
Literature
| Title | Journal |
|---|---|
| Fatal poisoning with Taxus baccata: quantification of paclitaxel (taxol A), 10-deacetyltaxol, baccatin III, 10-deacetylbaccatin III, cephalomannine (taxol B), and 3,5-dimethoxyphenol in body fluids by liquid chromatography-tandem mass spectrometry. | Journal of analytical toxicology 20120101 |
| Microbial detoxification of bifenthrin by a novel yeast and its potential for contaminated soils treatment. | PloS one 20120101 |
| On the way to understand antioxidants: chromanol and dimethoxyphenols gas-phase acidities. | Journal of mass spectrometry : JMS 20110701 |
| Importance of phenols structure on their activity as antinitrosating agents: A kinetic study. | Journal of pharmacy & bioallied sciences 20110101 |
| In situ lignocellulosic unlocking mechanism for carbohydrate hydrolysis in termites: crucial lignin modification. | Biotechnology for biofuels 20110101 |
| Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. | Bioorganic & medicinal chemistry letters 20101101 |
| [3,5-dimethoxyfenol--marker intoxication with Taxus baccata]. | Soudni lekarstvi 20100701 |
| Extracorporeal life support in a severe Taxus baccata poisoning. | Clinical toxicology (Philadelphia, Pa.) 20100601 |
| Preliminary gas chromatography with mass spectrometry determination of 3,5-dimethoxyphenol in biological specimens as evidence of taxus poisoning. | Journal of analytical toxicology 20100101 |
| Ethyl 2-(4-chloro-phen-yl)-3-(3,5-dimethoxy-phen-oxy)acrylate. | Acta crystallographica. Section E, Structure reports online 20081201 |
| Modern analytical procedures for the determination of taxus alkaloids in biological material. | International journal of legal medicine 20080701 |
| Chemical libraries via sequential C-H functionalization of phenols. | Journal of combinatorial chemistry 20080101 |
| A comparative study of five fatal cases of Taxus poisoning. | International journal of legal medicine 20070901 |
| Synthesis and cosmetic whitening effect of glycosides derived from several phenylpropanoids. | Yakugaku zasshi : Journal of the Pharmaceutical Society of Japan 20060301 |
| Total synthesis of garsubellin A. | Journal of the American Chemical Society 20060201 |
| Unusual pseudosubstrate specificity of a novel 3,5-dimethoxyphenol O-methyltransferase cloned from Ruta graveolens L. | Archives of biochemistry and biophysics 20050801 |
| [Suicidal yew poisoning--from Caesar to today--or suicide instructions on the internet]. | Archiv fur Kriminologie 20030101 |
| Biosynthesis of the major scent components 3,5-dimethoxytoluene and 1,3,5-trimethoxybenzene by novel rose O-methyltransferases. | FEBS letters 20020717 |
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