DIISOBUTYL KETONE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C9H18O
Molecular Weight	142.2386
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC(C)CC(=O)CC(C)C

InChI

InChIKey=PTTPXKJBFFKCEK-UHFFFAOYSA-N

InChI=1S/C9H18O/c1-7(2)5-9(10)6-8(3)4/h7-8H,5-6H2,1-4H3

HIDE SMILES / InChI

Molecular Formula	C9H18O
Molecular Weight	142.2386
Charge	0
Count

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

Approval Year

PubMed

Title	Date	PubMed
Toxicology and carcinogenesis studies of methyl isobutyl ketone (Cas No. 108-10-1) in F344/N rats and B6C3F1 mice (inhalation studies).	2007 Feb	17557116
Periplasmic phosphorylation of lipid A is linked to the synthesis of undecaprenyl phosphate.	2008 Jan	18047581
Simulation of repeated dose kinetics of methyl isobutyl ketone in humans from experimental single-dose inhalation exposure.	2008 Nov	18789368
Development of on-line single-drop micro-extraction sequential injection system for electrothermal atomic absorption spectrometric determination of trace metals.	2009 Jan 26	19110096
Effects of high-humidity aging on platinum, palladium, and gold loaded tin oxide--volatile organic compound sensors.	2010	22163564
Direct determination of bromine in plastics by electrothermal vaporization/inductively coupled plasma mass spectrometry using a tungsten boat furnace vaporizer and an exchangeable sample cuvette system.	2010 May 15	20391597

Patents

Substance Class	Chemical Created by `admin` on `Fri Dec 15 17:57:37 GMT 2023` Edited by `admin` on `Fri Dec 15 17:57:37 GMT 2023`
Record UNII	V52W30H1BU
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

DIISOBUTYL KETONE

Systematic Name

English

SYM-DIISOPROPY LACETONE

Common Name

English

DIISOBUTYL KETONE [HSDB]

Common Name

English

HEPTANONE, 2,6-DIMETHYL-, 4-

Systematic Name

English

2,6-DIMETHYL-4-HEPTANONE [FHFI]

Common Name

English

NSC-15136

Code

English

FEMA NO. 3537

Code

English

4-HEPTANONE, 2,6-DIMETHYL-

Systematic Name

English

ISOVALERONE

Systematic Name

English

SEC-DIISOPROPYL ACETONE

Common Name

English

2,6-DIMETHYL-4-HEPTANONE

Systematic Name

English

COGNAC HEPTANONE

Common Name

English

2,6-DIMETHYLHEPTAN-4-ONE

Systematic Name

English

Classification Tree Code System Code

EPA PESTICIDE CODE

44107