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Details

Stereochemistry ACHIRAL
Molecular Formula C8H16O
Molecular Weight 128.212
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-OCTANONE

SMILES

CCCCCC(=O)CC

InChI

InChIKey=RHLVCLIPMVJYKS-UHFFFAOYSA-N
InChI=1S/C8H16O/c1-3-5-6-7-8(9)4-2/h3-7H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C8H16O
Molecular Weight 128.212
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
In vivo volatile emissions from peanut plants induced by simultaneous fungal infection and insect damage.
2002 Jan
Comparison of volatile compound production in fruit body and in mycelium of Pleurotus ostreatus identified by submerged and solid-state cultures.
2002 Jul-Dec
Field evaluation of potential of alarm pheromone compounds to enhance baits for control of grass-cutting ants (Hymenoptera: Formicidae).
2002 Jun
Determination of unique microbial volatile organic compounds produced by five Aspergillus species commonly found in problem buildings.
2002 Mar-Apr
Impact odorants contributing to the fungus type aroma from grape berries contaminated by powdery mildew (Uncinula necator); incidence of enzymatic activities of the yeast Saccharomyces cerevisiae.
2002 May 22
Volatiles from whitefly-infested plants elicit a host-locating response in the parasitoid, Encarsia formosa.
2003 Jul
Tumor chemopreventive activity of 3-O-acylated (--)-epigallocatechins.
2003 Nov 17
Volatile organic compound (VOC) analysis and sources of limonene, cyclohexanone and straight chain aldehydes in axenic cultures of Calothrix and Plectonema.
2004
Main compounds responsible for off-odour of strawberries infected by Phytophthora cactorum.
2005
Volatile compounds of Aspergillus strains with different abilities to produce ochratoxin A.
2005 Mar 9
Volatile organic compounds in natural biofilm in polyethylene pipes supplied with lake water and treated water from the distribution network.
2005 Oct
Characterization of aroma-active compounds in raw and cooked pine-mushrooms (Tricholoma matsutake Sing.).
2006 Aug 23
[GC-MS analysis of volatile oil from the ear of Schizonepeta tenifolia Briq].
2006 Feb
Behavioral monitoring of trained insects for chemical detection.
2006 Jan-Feb
Difference in the volatile composition of pine-mushrooms (Tricholoma matsutake Sing.) according to their grades.
2006 Jun 28
Indoor molds, bacteria, microbial volatile organic compounds and plasticizers in schools--associations with asthma and respiratory symptoms in pupils.
2007 Apr
Host habitat assessment by a parasitoid using fungal volatiles.
2007 Feb 6
Production of volatile compounds by Rhizopus oligosporus during soybean and barley tempeh fermentation.
2007 Jan 25
Differentiation of aroma characteristics of pine-mushrooms (Tricholoma matsutake Sing.) of different grades using gas chromatography-olfactometry and sensory analysis.
2007 Mar 21
Chemostimuli implicated in selection of oviposition substrates by the stable fly Stomoxys calcitrans.
2007 Sep
Tricholoma matsutake 1-Ocen-3-ol and methyl cinnamate repel mycophagous Proisotoma minuta (Collembola: Insecta).
2008 Feb
Induction of conidiation by endogenous volatile compounds in Trichoderma spp.
2008 Jul
Predatory mite attraction to herbivore-induced plant odors is not a consequence of attraction to individual herbivore-induced plant volatiles.
2008 Jun
Correlation between the pattern volatiles and the overall aroma of wild edible mushrooms.
2008 Mar 12
(Z)-Methyl 4-[3-(3-oxoquinuclidin-2-yl-idenemeth-yl)-1H-indol-1-ylmeth-yl]benzoate.
2008 Oct 4
(Z)-4-[3-(3-Oxoquinuclidin-2-ylidene-meth-yl)-1H-indol-1-ylmeth-yl]benzo-nitrile.
2008 Oct 4
Antimicrobial activities of components of the glandular secretions of leaf cutting ants of the genus Atta.
2009 May
Influence of sporophore development, damage, storage, and tissue specificity on the enzymic formation of volatiles in mushrooms (Agaricus bisporus).
2009 May 13
Golgi-modifying properties of macfarlandin E and the synthesis and evaluation of its 2,7-dioxabicyclo[3.2.1]octan-3-one core.
2010 Apr 6
Different molecular types of Pseudomonas fragi have the same overall behaviour as meat spoilers.
2010 Aug 15
Optimisation of secondary electrospray ionisation (SESI) for the trace determination of gas-phase volatile organic compounds.
2010 Feb
Recognition of intermediate functionality by acyl carrier protein over a complete cycle of fatty acid biosynthesis.
2010 Jul 30
The predatory mite Phytoseiulus persimilis does not perceive odor mixtures as strictly elemental objects.
2010 Nov
Patents
Substance Class Chemical
Created
by admin
on Thu Jul 06 02:09:03 UTC 2023
Edited
by admin
on Thu Jul 06 02:09:03 UTC 2023
Record UNII
79173B4107
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-OCTANONE
FHFI   HSDB   MI  
Systematic Name English
3-OCTANONE [MI]
Common Name English
OCTANONE, 3-
Systematic Name English
NSC-60161
Code English
3-OCTANONE [FHFI]
Common Name English
ETHYL AMYL KETONE
Systematic Name English
FEMA NO. 2803
Code English
ETHYL N-PENTYL KETONE
Common Name English
3-OCTANONE [HSDB]
Common Name English
Classification Tree Code System Code
JECFA EVALUATION 3-OCTANONE
Created by admin on Thu Jul 06 02:09:03 UTC 2023 , Edited by admin on Thu Jul 06 02:09:03 UTC 2023
CFR 21 CFR 172.515
Created by admin on Thu Jul 06 02:09:03 UTC 2023 , Edited by admin on Thu Jul 06 02:09:03 UTC 2023
Code System Code Type Description
ECHA (EC/EINECS)
203-423-0
Created by admin on Thu Jul 06 02:09:03 UTC 2023 , Edited by admin on Thu Jul 06 02:09:03 UTC 2023
PRIMARY
PUBCHEM
246728
Created by admin on Thu Jul 06 02:09:03 UTC 2023 , Edited by admin on Thu Jul 06 02:09:03 UTC 2023
PRIMARY
HSDB
5371
Created by admin on Thu Jul 06 02:09:03 UTC 2023 , Edited by admin on Thu Jul 06 02:09:03 UTC 2023
PRIMARY
CHEBI
80946
Created by admin on Thu Jul 06 02:09:03 UTC 2023 , Edited by admin on Thu Jul 06 02:09:03 UTC 2023
PRIMARY
WIKIPEDIA
3-Octanone
Created by admin on Thu Jul 06 02:09:03 UTC 2023 , Edited by admin on Thu Jul 06 02:09:03 UTC 2023
PRIMARY
NSC
60161
Created by admin on Thu Jul 06 02:09:03 UTC 2023 , Edited by admin on Thu Jul 06 02:09:03 UTC 2023
PRIMARY
MERCK INDEX
M8112
Created by admin on Thu Jul 06 02:09:03 UTC 2023 , Edited by admin on Thu Jul 06 02:09:03 UTC 2023
PRIMARY Merck Index
CAS
106-68-3
Created by admin on Thu Jul 06 02:09:03 UTC 2023 , Edited by admin on Thu Jul 06 02:09:03 UTC 2023
PRIMARY
MESH
C017582
Created by admin on Thu Jul 06 02:09:03 UTC 2023 , Edited by admin on Thu Jul 06 02:09:03 UTC 2023
PRIMARY
FDA UNII
79173B4107
Created by admin on Thu Jul 06 02:09:03 UTC 2023 , Edited by admin on Thu Jul 06 02:09:03 UTC 2023
PRIMARY
EPA CompTox
DTXSID3041954
Created by admin on Thu Jul 06 02:09:03 UTC 2023 , Edited by admin on Thu Jul 06 02:09:03 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> CONSTITUENT ALWAYS PRESENT
ASSAY (GC)