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1-Hexanol

analytical standard

Synonym(s):

Hexyl alcohol

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About This Item

Linear Formula:
CH3(CH2)5OH
CAS Number:
111-27-3
Molecular Weight:
102.17
Beilstein/REAXYS Number:
969167
EC Number:
203-852-3
MDL number:
MFCD00002982
UNSPSC Code:
41116107
PubChem Substance ID:
329764628
NACRES:
NA.24

grade

analytical standard

Quality Level

100

vapor density

4.5 (vs air)

vapor pressure

1 mmHg ( 25.6 °C)

assay

≥99.9% (GC)

autoignition temp.

559 °F

shelf life

limited shelf life, expiry date on the label

technique(s)

HPLC: suitable
gas chromatography (GC): suitable

refractive index

n20/D 1.418 (lit.)
n20/D 1.418

bp

156-157 °C (lit.)

mp

−52 °C (lit.)

density

0.814 g/mL at 25 °C (lit.)

application(s)

cleaning products
cosmetics
environmental
flavors and fragrances
food and beverages
personal care

format

neat

SMILES string

CCCCCCO

InChI

1S/C6H14O/c1-2-3-4-5-6-7/h7H,2-6H2,1H3

InChI key

ZSIAUFGUXNUGDI-UHFFFAOYSA-N

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Related Categories

General description

1-Hexanol is an organic alcohol, which has application in the synthesis of antiseptics, fragrances, perfumes, etc. It is also used as a component of plasticizers.

Application

1-Hexanol may be used as an analytical standard for the determination of the analyte in wine, plant samples, flowers, fruits and oil samples by various chromatography techniques.
Refer to the product′s Certificate of Analysis for more information on a suitable instrument technique. Contact Technical Service for further support.

pictograms

FlameExclamation mark
GHS02,GHS07

signalword

Warning

Hazard Classifications

Acute Tox. 4 Dermal - Acute Tox. 4 Oral - Eye Irrit. 2 - Flam. Liq. 3

Storage Class

3 - Flammable liquids

wgk_germany

WGK 1

flash_point_f

140.0 °F - closed cup

flash_point_c

60 °C - closed cup

ppe

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

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Certificates of Analysis (COA)

Lot/Batch Number

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Patty?s toxicology, 6 volume set
Patty's Toxicology (2012)
On-line gas chromatography combustion/pyrolysis isotope ratio mass spectrometry (HRGC-C/P-IRMS) of major volatiles from pear fruit (Pyrus communis) and pear products
Kahle K, et al.
Food Chemistry, 91(3), 449-455 (2005)
J Ruther
Journal of chromatography. A, 890(2), 313-319 (2000-09-29)
A series of ubiquitously occurring saturated and monounsaturated six-carbon aldehydes, alcohols and esters thereof is summarised as 'green leaf volatiles' (GLVs). The present study gives a comprehensive data collection of retention indices of 35 GLVs on commonly used non-polar DB-5
C Ortega et al.
Journal of chromatography. A, 923(1-2), 205-214 (2001-08-21)
A method for the simultaneous determination of major (10-200 mg/l) and minor (0.1-10 mg/l) volatile compounds from wine has been optimised and validated. A 3-ml volume of wine is diluted with water (7 ml), salted with 4.5 g of ammonium
Justin T Mohr et al.
Journal of medicinal chemistry, 48(12), 4172-4176 (2005-06-10)
The polyhydroxyalkanes 1,6,11,16-hexadecanetetraol (1) and 2,7,12,17-octadecanetetraol (2) were synthesized utilizing the thiophene ring as a scaffold to affix the hydroxyalkyl chains by lithiation of the acidic alpha-hydrogens and subsequent desulfurization. Both compounds exhibited significant anesthetic potency, individually and in additivity
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