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Merck
CN

410659

4-Hydroxy-3-methoxyphenylacetone

96%

Synonym(s):

1-(4-Hydroxy-3-methoxyphenyl)-2-propanone, 2-Propiovanillone, 4-Hydroxy-3-methoxyphenyl-2-propanone, Guaiacylacetone, Methyl vanillyl ketone, Vanillyl methyl ketone

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About This Item

Linear Formula:
HOC6H3(OCH3)CH2COCH3
CAS Number:
Molecular Weight:
180.20
NACRES:
NA.22
PubChem Substance ID:
UNSPSC Code:
12352100
EC Number:
219-704-6
MDL number:
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Product Name

4-Hydroxy-3-methoxyphenylacetone, 96%

InChI key

LFVCJQWZGDLHSD-UHFFFAOYSA-N

InChI

1S/C10H12O3/c1-7(11)5-8-3-4-9(12)10(6-8)13-2/h3-4,6,12H,5H2,1-2H3

SMILES string

COc1cc(CC(C)=O)ccc1O

assay

96%

form

liquid

refractive index

n20/D 1.55 (lit.)

bp

126-127 °C/0.3 mmHg (lit.)

density

1.163 g/mL at 25 °C (lit.)

functional group

ketone

Quality Level

pictograms

Exclamation mark

signalword

Warning

Hazard Classifications

Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

target_organs

Respiratory system

Storage Class

10 - Combustible liquids

wgk

WGK 3

flash_point_f

235.4 °F - closed cup

flash_point_c

113 °C - closed cup

ppe

Eyeshields, Gloves, type ABEK (EN14387) respirator filter


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J Jodynis-Liebert
Xenobiotica; the fate of foreign compounds in biological systems, 23(6), 693-701 (1993-06-01)
1. Metabolites of 1-(4-hydroxy-3-methoxyphenyl)-2-propanone (HMP-one), a smoke flavour compound, were isolated from rat urine using hydrolysis, ether extraction, t.l.c. and g.l.c. 2. Three metabolites were identified by mass spectrometry and independent synthesis, namely: 1-(3, 4-dihydroxyphenyl)-2-propanone (Met I), 1-(3, 4-dihydroxyphenyl)-2-propanol (Met
Aqueous-phase hydrodeoxygenation of bio-derived phenols to cycloalkanes.
Zhao C, et al.
J. Catal., 280(1), 8-16 (2011)
Michaela Kolb et al.
Journal of chromatography. A, 1307, 144-157 (2013-08-13)
A headspace solid-phase microextraction method with subsequent GC-MS (HS-SPME/GC-MS) was established for the quantitative analysis of volatile lignin derived phenolic monomers in complex aqueous solutions. Extraction was done using a polyacrylate fiber. The optimization of HS-SPME - parameters was performed
Mary L Forsling et al.
British journal of pharmacology, 135(3), 649-656 (2002-02-09)
Methylenedioxymethamphetamine (MDMA, 'ecstasy'), widely used as a recreational drug, can produce hyponatraemia. The possibility that this could result from stimulation of vasopressin by MDMA or one of its metabolites has been investigated in vitro. Release of both oxytocin and vasopressin
H J Helmlin et al.
Journal of analytical toxicology, 20(6), 432-440 (1996-10-01)
In Europe, the compound 3,4-methylenedioxymethamphetamine (MDMA, Ecstasy, Adam), in addition to cannabis, is the most abused illicit drug at all-night "techno" parties. Methods for the determination of MDMA and its metabolites, 4-hydroxy-3-methoxymethamphetamine (HMMA), 3,4-dihydroxy-methamphetamine (HHMA), 3,4-methylenedioxyamphetamine (MDA), 4-hydroxy-3-methoxyamphetamine (HMA), and

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