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Supelco

1-Hexanol

analytical standard

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Synonym(s):
Hexyl alcohol
Linear Formula:
CH3(CH2)5OH
CAS Number:
111-27-3
Molecular Weight:
102.17
Beilstein:
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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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

Signal Word

Warning

Hazard Statements

H226,H302 + H312,H319

Hazard Classifications

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

WGK

WGK 1

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Regulatory Information

危险化学品

Certificates of Analysis (COA)

Search for Certificates of Analysis (COA) by entering the products Lot/Batch Number. Lot and Batch Numbers can be found on a product’s label following the words ‘Lot’ or ‘Batch’.

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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)
Patty?s toxicology, 6 volume set
Patty's Toxicology (2012)
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
Profiling the chemical content of Opuntia ficus-indica flowers by HPLC-PDA-ESI-MS and GC/EIMS analyses
De Leo M, et al.
Phytochemistry Letters, 3(1), 48-52 (2010)
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
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