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2-Hexanone

analytical standard

Synonym(s):

Butyl methyl ketone

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About This Item

Linear Formula:
CH3(CH2)3COCH3
CAS Number:
591-78-6
Molecular Weight:
100.16
Beilstein/REAXYS Number:
1737676
EC Number:
209-731-1
MDL number:
MFCD00009482
UNSPSC Code:
77101502
PubChem Substance ID:
329757339
NACRES:
NA.24

grade

analytical standard

Quality Level

100

agency

ASTM® D5580

vapor pressure

10 mmHg ( 39 °C)

CofA

current certificate can be downloaded

packaging

pkg of 5 mL

technique(s)

HPLC: suitable
gas chromatography (GC): suitable

refractive index

n20/D 1.401 (lit.)

bp

127 °C (lit.)

mp

−57 °C (lit.)

density

0.812 g/mL at 25 °C (lit.)

application(s)

cleaning products
cosmetics
food and beverages
personal care
petroleum

format

neat

storage temp.

2-30°C

SMILES string

CCCCC(C)=O

InChI

1S/C6H12O/c1-3-4-5-6(2)7/h3-5H2,1-2H3

InChI key

QQZOPKMRPOGIEB-UHFFFAOYSA-N

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General description

2-Hexanone is a colorless to pale yellow liquid with sharp odor belonging to the class of ketones. It is obtained as a waste product of coal gasification, oil shale operations and wood pulping. It is widely used as a solvent in industry.

Application

2-Hexanone may be used as an analytical reference standard for the quantification of the analyte in biological samples using liquid chromatography−tandem mass spectrometry (LC−MS−MS).
Refer to the product′s Certificate of Analysis for more information on a suitable instrument technique. Contact Technical Service for further support.

Legal Information

ASTM is a registered trademark of American Society for Testing and Materials

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Danger

Hazard Classifications

Flam. Liq. 3 - Repr. 2 - STOT RE 1 - STOT SE 3

target_organs

Central nervous system

wgk_germany

WGK 1

flash_point_f

73.4 °F

flash_point_c

23 °C

ppe

Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter

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Certificates of Analysis (COA)

Lot/Batch Number
LRAD2520
LRAC2485
LRAB8534
LRAB5733
LC25648V

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Application of liquid chromatography-mass spectrometry to biomonitoring of exposure to industrial chemicals
Manini P, et al.
Toxicology Letters, 162(2-3), 202-210 (2006)
Handbook of Chemicals and Safety (2016)
Y Lolin
Human toxicology, 8(4), 293-300 (1989-07-01)
1. The main neurological disorders associated with chronic VSA are peripheral neuropathy, cerebellar disease, chronic encephalopathy and dementia. Apart from peripheral neuropathy, the clinical features are non-specific, evidence for solvent-related toxicity is in most cases circumstantial and there is no
J W Griffin
Neurobehavioral toxicology and teratology, 3(4), 437-444 (1981-01-01)
The neurotoxicity of hexacarbon solvents has become apparent only recently, but an extensive literature has already developed as a result of the clinical and epidemiological implications of the human disease, and the advantages of small animal models of hexacarbon neurotoxicity
Bo Sahlberg et al.
The Science of the total environment, 444, 433-440 (2013-01-03)
There are few studies on associations between airborne microbial exposure, formaldehyde, plasticizers in dwellings and the symptoms compatible with the sick building syndrome (SBS). As a follow-up of the European Community Respiratory Health Survey (ECRHS II), indoor measurements were performed
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Protocols

US EPA Method 8260: GC Analysis of Volatiles on SPB®-624 after Purge & Trap using "K" Trap, Fast GC Analysis

US EPA Method 8260 describes the analysis of volatile organic compounds in solid wastes and ground waters. This application illustrates the analysis of many compounds commonly analyzed by this method using purge and trap coupled to GC-MS.

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