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Details

Stereochemistry ACHIRAL
Molecular Formula C9H10O
Molecular Weight 134.1751
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PHENYLACETONE

SMILES

CC(=O)CC1=CC=CC=C1

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 134.1751
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Unknown
139594
Targets

Targets

Primary TargetPharmacologyConditionPotency
Acetylcholinesterase
207
Target ID: O42275
Gene ID: NA
Gene Symbol: ache
Target Organism: Electrophorus electricus (Electric eel) (Gymnotus electricus)
Inhibitor
8297
PubMed

PubMed

TitleDatePubMed
A re-examination of the mono-methoxy positional ring isomers of amphetamine, methamphetamine and phenyl-2-propanone.
2001 Jun 15
SPME/GC-MS characterization of volatiles associated with methamphetamine: toward the development of a pseudomethamphetamine training material.
2001 Sep
Rotational spectra and conformational structures of 1-phenyl-2-propanol, methamphetamine, and 1-phenyl-2-propanone.
2006 Dec 14
Diffusion measurements in binary liquid mixtures by Raman spectroscopy.
2007 Apr
A Thermoanaerobacter ethanolicus secondary alcohol dehydrogenase mutant derivative highly active and stereoselective on phenylacetone and benzylacetone.
2007 Feb
Development of a harmonised method for the profiling of amphetamines VI: Evaluation of methods for comparison of amphetamine.
2007 Jun 14
Kinetic mechanism of phenylacetone monooxygenase from Thermobifida fusca.
2008 Apr 1
N-cyanomethyl-N-methyl-1-(3',4'-methylenedioxyphenyl)-2-propylamine: an MDMA manufacturing by-product.
2008 Sep
Isopropyl 2-[5-(4-hydroxy-phen-yl)-3-methyl-sulfanyl-1-benzofuran-2-yl]acetate.
2009 Aug 29
p-Aminophenylacetic acid-mediated synthesis of monodispersed titanium oxide hybrid microspheres in ethanol solution.
2009 Oct 15
2,3,6-Triphenyl-piperidin-4-one.
2009 Sep 12
Diethyl 4-(2,4-dichloro-phen-yl)-2,6-dimethyl-1,4-dihydro-pyridine-3,5-dicarboxyl-ate.
2010 Jan 16
Defensive secretions in three species of polydesmids (Diplopoda, Polydesmida, Polydesmidae).
2010 Sep
Patents

Patents

03956374
7
03978057
3
03998971
1
JPS59225126A
1
JPS5953476A
1
JPS5978183A
1
JPS60207591A
1
JPS6081167A
1
Substance Class Chemical
Created
by admin
on Fri Dec 15 15:24:06 GMT 2023
Edited
by admin
on Fri Dec 15 15:24:06 GMT 2023
Record UNII
O7IZH10V9Y
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
PHENYLACETONE
MI  
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 IMPURITY]
Common Name English
NSC-9827
Code English
DEXTROAMPHETAMINE RELATED COMPOUND B [USP IMPURITY]
Common Name English
DEXTROAMPHETAMINE RELATED COMPOUND B CII
USP-RS  
Common Name English
DEXTROAMPHETAMINE RELATED COMPOUND B
USP  
Common Name English
PHENYLACETONE [MI]
Common Name English
Classification Tree Code System Code
DEA NO. 8501
Created by admin on Fri Dec 15 15:24:06 GMT 2023 , Edited by admin on Fri Dec 15 15:24:06 GMT 2023
Code System Code Type Description
NSC
9827
Created by admin on Fri Dec 15 15:24:06 GMT 2023 , Edited by admin on Fri Dec 15 15:24:06 GMT 2023
PRIMARY
CHEBI
52052
Created by admin on Fri Dec 15 15:24:06 GMT 2023 , Edited by admin on Fri Dec 15 15:24:06 GMT 2023
PRIMARY
FDA UNII
O7IZH10V9Y
Created by admin on Fri Dec 15 15:24:06 GMT 2023 , Edited by admin on Fri Dec 15 15:24:06 GMT 2023
PRIMARY
ECHA (EC/EINECS)
203-144-4
Created by admin on Fri Dec 15 15:24:06 GMT 2023 , Edited by admin on Fri Dec 15 15:24:06 GMT 2023
PRIMARY
EPA CompTox
DTXSID1059280
Created by admin on Fri Dec 15 15:24:06 GMT 2023 , Edited by admin on Fri Dec 15 15:24:06 GMT 2023
PRIMARY
MESH
C008863
Created by admin on Fri Dec 15 15:24:06 GMT 2023 , Edited by admin on Fri Dec 15 15:24:06 GMT 2023
PRIMARY
RS_ITEM_NUM
1180026
Created by admin on Fri Dec 15 15:24:06 GMT 2023 , Edited by admin on Fri Dec 15 15:24:06 GMT 2023
PRIMARY
PUBCHEM
7678
Created by admin on Fri Dec 15 15:24:06 GMT 2023 , Edited by admin on Fri Dec 15 15:24:06 GMT 2023
PRIMARY
CAS
103-79-7
Created by admin on Fri Dec 15 15:24:06 GMT 2023 , Edited by admin on Fri Dec 15 15:24:06 GMT 2023
PRIMARY
WIKIPEDIA
PHENYLACETONE
Created by admin on Fri Dec 15 15:24:06 GMT 2023 , Edited by admin on Fri Dec 15 15:24:06 GMT 2023
PRIMARY
MERCK INDEX
m8651
Created by admin on Fri Dec 15 15:24:06 GMT 2023 , Edited by admin on Fri Dec 15 15:24:06 GMT 2023
PRIMARY Merck Index
Related Record Type Details
Structure of LISDEXAMFETAMINE
PARENT -> METABOLITE
Structure of DEXTROAMPHETAMINE
PARENT -> METABOLITE
Structure of AMPHETAMINE
PARENT -> METABOLITE
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Structure of APAAN
PARENT -> IMPURITY
Structure of DEXTROAMPHETAMINE SULFATE
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
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Structure of AMPHETAMINE SULFATE
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
Structure of PHENYLACETONITRILE
PARENT -> IMPURITY
Structure of AMPHETAMINE SULFATE
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
USP
NIH
NCATS
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