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Merck
CN

41513

2-Hexanol

analytical standard

Synonym(s):

(±)-2-Hexanol, Butyl methyl carbinol

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About This Item

Linear Formula:
CH3(CH2)3CH(OH)CH3
CAS Number:
Molecular Weight:
102.17
UNSPSC Code:
85151701
NACRES:
NA.24
PubChem Substance ID:
EC Number:
210-971-4
Beilstein/REAXYS Number:
1718996
MDL number:
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grade

analytical standard

Quality Level

assay

≥98.0% (GC)

shelf life

limited shelf life, expiry date on the label

refractive index

n20/D 1.414 (lit.), n20/D 1.415

bp

136 °C (lit.)

density

0.814 g/mL at 20 °C, 0.81 g/mL at 25 °C (lit.)

application(s)

cleaning products
cosmetics
flavors and fragrances
food and beverages
personal care

format

neat

SMILES string

CCCCC(C)O

InChI

1S/C6H14O/c1-3-4-5-6(2)7/h6-7H,3-5H2,1-2H3

InChI key

QNVRIHYSUZMSGM-UHFFFAOYSA-N

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General description

2-Hexanol is a volatile aromatic alcohol abundantly occurring in various plant materials. It is often found as a constituent of food and beverages.

Application

2-Hexanol may be used as an analytical standard for the determination of the analyte in biological samples, fruits, soymilk, food, and aqueous samples by various chromatography techniques.

pictograms

Flame

signalword

Warning

hcodes

Hazard Classifications

Flam. Liq. 3

Storage Class

3 - Flammable liquids

wgk

WGK 1

flash_point_f

114.8 °F - closed cup

flash_point_c

46 °C - closed cup

Regulatory Information

危险化学品

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F Schade et al.
Phytochemistry, 56(7), 703-710 (2001-04-21)
Thirteen major volatiles of the carnation flower fragrance signature have been identified by GC/MS. Of these, ten, hexanal, (2E)-hexenal, 1-hexanol, 2-hexanol, 3-hexen-1-ol, nonanal, benzaldehyde, benzyl alcohol, benzyl benzoate and caryophyllene, were quantified. The steady-state levels of these ten volatiles change
Identification of volatile compounds in soymilk using solid-phase microextraction-gas chromatography
Achouri A, et al.
Food Chemistry, 99(4), 759-766 (2006)
Analysis of volatile flavor components in roasted peanuts using supercritical fluid extraction and gas chromatography- mass spectrometry
Leunissen M, et al.
Journal of Agricultural and Food Chemistry, 44(9), 2694-2699 (1996)
Analysis of n-hexane, 2-hexanone, 2, 5-hexanedione, and related chemicals by capillary gas chromatography and high-performance liquid chromatography
Nomeir AA and Abou-Donia MB
Analytical biochemistry, 151(2), 381-388 (1985)
Enantioselective multidimensional gas chromatography of some secondary alcohols and their acetates from banana
Schubert V, et al.
Zeitschrift fur Naturforschung C, 46(1-2), 33-36 (1991)

Global Trade Item Number

SKUGTIN
41513-1ML04061832086163

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