PHENYLACETONE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C9H10O
Molecular Weight	134.1754
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC(=O)Cc1ccccc1

InChI

InChIKey=QCCDLTOVEPVEJK-UHFFFAOYSA-N

InChI=1S/C9H10O/c1-8(10)7-9-5-3-2-4-6-9/h2-6H,7H2,1H3

HIDE SMILES / InChI

Molecular Formula	C9H10O
Molecular Weight	134.1754
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Targets

Primary Target	Pharmacology	Condition	Potency
Acetylcholinesterase 201 Target ID: O42275 Gene ID: NA Gene Symbol: ache Target Organism: Electrophorus electricus (Electric eel) (Gymnotus electricus) Sources: https://www.ncbi.nlm.nih.gov/pubmed/20963	Inhibitor 7728

PubMed

Title	Date	PubMed
A re-examination of the mono-methoxy positional ring isomers of amphetamine, methamphetamine and phenyl-2-propanone.	2001 Jun 15	11376983
SPME/GC-MS characterization of volatiles associated with methamphetamine: toward the development of a pseudomethamphetamine training material.	2001 Sep	11569539
[The enhancement effect of emulsion in flame atomic absorption spectrometry].	2002 Aug	12938401
The modulation of androgen metabolism by estradiol, minocycline, and indomethacin in a cell culture model.	2002 Jun	12083529
Anise oil as para-methoxyamphetamine (PMA) precursor.	2003 Apr 23	12742705
Convergent synthesis and preliminary biological evaluations of the stilbenolignan (+/-)-aiphanol and various congeners.	2003 Jul 21	12956057
Microbial degradation of illicit drugs, their precursors, and manufacturing by-products: implications for clandestine drug laboratory investigation and environmental assessment.	2003 Jun 24	12842360
Cerium(III) chloride-mediated reactions of sulfonamide dianions.	2003 Jun 27	12816492
Impurity profiling of methamphetamine hydrochloride drugs seized in the Philippines.	2004 Aug 11	15240018
Cholesterol-lowering properties of Ganoderma lucidum in vitro, ex vivo, and in hamsters and minipigs.	2004 Feb 18	14969592
The prodrug activator EtaA from Mycobacterium tuberculosis is a Baeyer-Villiger monooxygenase.	2004 Jan 30	14610090
Impurity profiling/comparative analyses of samples of 1-phenyl-2-propanone.	2005	21338015
Discovery of a thermostable Baeyer-Villiger monooxygenase by genome mining.	2005 Jan	15599520
1,4- and 2,4-substituted-1,2,3-triazoles as potential potassium channel activators. VII.	2005 May	15910810
Development of a harmonized method for the profiling of amphetamines. I. Synthesis of standards and compilation of analytical data.	2005 May 10	15749364
Towards practical biocatalytic Baeyer-Villiger reactions: applying a thermostable enzyme in the gram-scale synthesis of optically-active lactones in a two-liquid-phase system.	2005 Oct 7	16542025
Rotational spectra and conformational structures of 1-phenyl-2-propanol, methamphetamine, and 1-phenyl-2-propanone.	2006 Dec 14	17149832
Identification of impurities and the statistical classification of methamphetamine using headspace solid phase microextraction and gas chromatography-mass spectrometry.	2006 Jun 27	16188412
Synthesis, isolation, and structural characterization of the C4h isomer of metal(1,2-naphthalocyanine) and its one-dimensional conductor of the axially substituted species.	2006 May 15	16676978
Antioxidant effects of glutathione and IGF in a hyperglycaemic cell culture model of fibroblasts: some actions of advanced glycaemic end products (AGE) and nicotine.	2006 Sep	17017979
Diffusion measurements in binary liquid mixtures by Raman spectroscopy.	2007 Apr	17456254
A Thermoanaerobacter ethanolicus secondary alcohol dehydrogenase mutant derivative highly active and stereoselective on phenylacetone and benzylacetone.	2007 Feb	17283007
Asymmetric reduction and oxidation of aromatic ketones and alcohols using W110A secondary alcohol dehydrogenase from Thermoanaerobacter ethanolicus.	2007 Jan 5	17194078
Development of a harmonised method for the profiling of amphetamines VI: Evaluation of methods for comparison of amphetamine.	2007 Jun 14	17182203
Development of a harmonised method for the profiling of amphetamines: III. Development of the gas chromatographic method.	2007 Jun 14	17174497
Development of a harmonised method for the profiling of amphetamines: IV. Optimisation of sample preparation.	2007 Jun 14	17134863
Kinetic mechanism of phenylacetone monooxygenase from Thermobifida fusca.	2008 Apr 1	18321069
Chronic experimental diabetes accelerates urinary elimination of deprenyl and its metabolites.	2008 Jan 10	19662137
Trace evidence of trans-phenylpropene as a marker of smoked methamphetamine.	2008 Oct	19007525
N-cyanomethyl-N-methyl-1-(3',4'-methylenedioxyphenyl)-2-propylamine: an MDMA manufacturing by-product.	2008 Sep	18637869
Isopropyl 2-[5-(4-hydroxy-phen-yl)-3-methyl-sulfanyl-1-benzofuran-2-yl]acetate.	2009 Aug 29	21577662
Comparative analysis of 1-phenyl-2-propanone (P2P), an amphetamine-type stimulant precursor, using stable isotope ratio mass spectrometry: presented in part as a poster at the 2nd meeting of the Joint European Stable Isotope User Meeting (JESIUM), Giens, France, September 2008.	2009 Jun	19606587
p-Aminophenylacetic acid-mediated synthesis of monodispersed titanium oxide hybrid microspheres in ethanol solution.	2009 Oct 15	19616218
Halonium ion-assisted deiodination of styrene-based vicinal iodohydrins followed by rearrangement through phenyl migration.	2009 Oct 16	19764730
Laboratory evolution of robust and enantioselective Baeyer-Villiger monooxygenases for asymmetric catalysis.	2009 Oct 28	19807086
Characterization of route specific impurities found in methamphetamine synthesized by the Leuckart and reductive amination methods.	2009 Sep 1	19637924
2,3,6-Triphenyl-piperidin-4-one.	2009 Sep 12	21577886
The Catalytic Function of Nonheme Iron (III) Complex for Hydrocarbon Oxidation.	2010	20689711
New chiral phosphoramidite complexes of iron as catalytic precursors in the oxidation of activated methylene groups.	2010 Apr 12	20428070
Azido-(benzoyl-acetonato-κO,O')[1-phenyl-3-(2-pyridylmethyl-imino)but-1-en-1-olato-κN,N',O]cobalt(III).	2010 Feb 3	21580204
Diethyl 4-(2,4-dichloro-phen-yl)-2,6-dimethyl-1,4-dihydro-pyridine-3,5-dicarboxyl-ate.	2010 Jan 16	21579787
Sequencing around 5-hydroxyconiferyl alcohol-derived units in caffeic acid O-methyltransferase-deficient poplar lignins.	2010 Jun	20427467
CE assay for simultaneous determination of charged and neutral impurities in dexamphetamine sulfate using a dual CD system.	2010 May	20358547
Investigating the coenzyme specificity of phenylacetone monooxygenase from Thermobifida fusca.	2010 Nov	20703875
Improved synthesis of (S)-1-phenyl-2-propanol in high concentration with coupled whole cells of Rhodococcus erythropolis and Bacillus subtilis on preparative scale.	2010 Nov	20490950
Phytoconstituents from Alpinia purpurata and their in vitro inhibitory activity against Mycobacterium tuberculosis.	2010 Oct	21120040
Defensive secretions in three species of polydesmids (Diplopoda, Polydesmida, Polydesmidae).	2010 Sep	20809146
Detection of volatile indicators of illicit substances by the olfactory receptors of Drosophila melanogaster.	2010 Sep	20530374

Patents

Substance Class	Chemical Created by `admin` on `Sat Jun 26 05:12:55 UTC 2021` Edited by `admin` on `Sat Jun 26 05:12:55 UTC 2021`
Record UNII	O7IZH10V9Y
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

PHENYLACETONE

Systematic Name

English

1-PHENYL-2-PROPANONE

Systematic Name

English

METHYL BENZYL KETONE

Systematic Name

English

BENZYL METHYL KETONE

Systematic Name

English

DEXTROAMPHETAMINE RELATED COMPOUND B [USP-RS]

Common Name

English

AMFETAMINE SULFATE IMPURITY B [EP]

Common Name

English

NSC-9827

Code

English

DEXTROAMPHETAMINE RELATED COMPOUND B CII

Common Name

English

DEXTROAMPHETAMINE RELATED COMPOUND B

Common Name

English

DEXTROAMPHETAMINE RELATED COMPOUND B [USP]

Common Name

English

PHENYLACETONE [MI]

Common Name

English

Classification Tree Code System Code

DEA NO.

8501