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Details

Stereochemistry ACHIRAL
Molecular Formula C10H12O
Molecular Weight 148.2017
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-Phenyl-2-butanone

SMILES

CC(=O)CCC1=CC=CC=C1

InChI

InChIKey=AKGGYBADQZYZPD-UHFFFAOYSA-N
InChI=1S/C10H12O/c1-9(11)7-8-10-5-3-2-4-6-10/h2-6H,7-8H2,1H3

HIDE SMILES / InChI

Molecular Formula C10H12O
Molecular Weight 148.2017
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
Chemical composition of volatile oils of Aquilaria malaccensis (Thymelaeaceae) from Malaysia.
2010-12
(η-Penta-methyl-cyclo-penta-dien-yl)(η-4-phenyl-butan-2-one)ruthenium(II) tetra-phenyl-borate.
2010-11-13
Chemical compositions, antifungal and antioxidant activities of essential oil and various extracts of Melodorum fruticosum L. flowers.
2010-10
Silencing NaTPI expression increases nectar germin, nectarins, and hydrogen peroxide levels and inhibits nectar removal from plants in nature.
2010-04
Changing pollinators as a means of escaping herbivores.
2010-02-09
[Synthesis and investigation on antidiabetic activity of 4-(1-aryl-3-oxo-5-phenylpentylamino) benzenesulfonamide].
2010-01
DNA-targeting pyrroloquinoline-linked butenone and chalcones: synthesis and biological evaluation.
2009-07
Field experiments with transformed plants reveal the sense of floral scents.
2008-08-29
Plant science. The "invisible hand" of floral chemistry.
2008-08-29
t-3-Benzyl-r-2,c-6-bis-(4-methoxy-phen-yl)-piperidin-4-one.
2008-06-07
Sedative effects of vapor inhalation of agarwood oil and spikenard extract and identification of their active components.
2008-01
Total synthesis of natural product (R)-4-phenyl-2-O-[beta-D-xylopyranosyl(1-->6)-beta-D-glucopyranosyl]butane and its epimer.
2007-06-15
Making sense of nectar scents: the effects of nectar secondary metabolites on floral visitors of Nicotiana attenuata.
2007-03
Purification and characterization of alcohol dehydrogenase reducing N-benzyl-3-pyrrolidinone from Geotrichum capitatum.
2007-02
A Thermoanaerobacter ethanolicus secondary alcohol dehydrogenase mutant derivative highly active and stereoselective on phenylacetone and benzylacetone.
2007-02
Asymmetric reduction and oxidation of aromatic ketones and alcohols using W110A secondary alcohol dehydrogenase from Thermoanaerobacter ethanolicus.
2007-01-05
Dakin-West synthesis of beta-aryl ketones.
2006-08-18
Antioxidant and free radical scavenging activities of Misodendrum punctulatum, myzodendrone and structurally related phenols.
2005-12
ISSR and AFLP analysis of the temporal and spatial population structure of the post-fire annual, Nicotiana attenuata, in SW Utah.
2004-09-06
Dorycnioside, a new phenylbutanone glucoside from Dorycnium pentaphyllum subsp. herbaceum.
2004-03-17
The prodrug activator EtaA from Mycobacterium tuberculosis is a Baeyer-Villiger monooxygenase.
2004-01-30
Opportunistic out-crossing in Nicotiana attenuata (Solanaceae), a predominantly self-fertilizing native tobacco.
2003-07-16
Reductive metabolism of an alpha,beta-ketoalkyne, 4-phenyl-3-butyn-2-one, by rat liver preparations.
2002-04
Influence of the N-B transition of human serum albumin on the structure of the warfarin-binding site.
1987-09-24
Patents
Substance Class Chemical
Created
by admin
on Mon Mar 31 19:32:44 GMT 2025
Edited
by admin
on Mon Mar 31 19:32:44 GMT 2025
Record UNII
UZM5QH16YW
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NSC-44829
Preferred Name English
4-Phenyl-2-butanone
Systematic Name English
2-PHENYLETHYL METHYL KETONE
Systematic Name English
1-PHENYL-3-BUTANONE
Systematic Name English
2-BUTANONE, 4-PHENYL-
Systematic Name English
PHENETHYL METHYL KETONE
Systematic Name English
4-PHENYL BUTANONE
Systematic Name English
METHYL 2-PHENYLETHYL KETONE
Systematic Name English
BENZYLACETONE
Systematic Name English
METHYL PHENETHYL KETONE
Systematic Name English
NSC-813
Code English
Code System Code Type Description
SMS_ID
100000171967
Created by admin on Mon Mar 31 19:32:44 GMT 2025 , Edited by admin on Mon Mar 31 19:32:44 GMT 2025
PRIMARY
CAS
2550-26-7
Created by admin on Mon Mar 31 19:32:44 GMT 2025 , Edited by admin on Mon Mar 31 19:32:44 GMT 2025
PRIMARY
FDA UNII
UZM5QH16YW
Created by admin on Mon Mar 31 19:32:44 GMT 2025 , Edited by admin on Mon Mar 31 19:32:44 GMT 2025
PRIMARY
EPA CompTox
DTXSID6033241
Created by admin on Mon Mar 31 19:32:44 GMT 2025 , Edited by admin on Mon Mar 31 19:32:44 GMT 2025
PRIMARY
WIKIPEDIA
Benzylacetone
Created by admin on Mon Mar 31 19:32:44 GMT 2025 , Edited by admin on Mon Mar 31 19:32:44 GMT 2025
PRIMARY
PUBCHEM
17355
Created by admin on Mon Mar 31 19:32:44 GMT 2025 , Edited by admin on Mon Mar 31 19:32:44 GMT 2025
PRIMARY
ECHA (EC/EINECS)
219-847-4
Created by admin on Mon Mar 31 19:32:44 GMT 2025 , Edited by admin on Mon Mar 31 19:32:44 GMT 2025
PRIMARY
NSC
813
Created by admin on Mon Mar 31 19:32:44 GMT 2025 , Edited by admin on Mon Mar 31 19:32:44 GMT 2025
PRIMARY
NSC
44829
Created by admin on Mon Mar 31 19:32:44 GMT 2025 , Edited by admin on Mon Mar 31 19:32:44 GMT 2025
PRIMARY