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77597

Supelco

1-Pentanol

analytical standard

Synonym(s):

n-Amyl alcohol, Pentyl alcohol

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About This Item

Linear Formula:
CH3(CH2)4OH
CAS Number:
Molecular Weight:
88.15
Beilstein:
1730975
EC Number:
MDL number:
UNSPSC Code:
41116107
PubChem Substance ID:
NACRES:
NA.24

grade

analytical standard

Quality Level

vapor density

3 (vs air)

vapor pressure

1 mmHg ( 13.6 °C)
1.5 mmHg ( 20 °C)

Assay

≥99.8% (GC)

shelf life

limited shelf life, expiry date on the label

expl. lim.

10 %, 100 °F

technique(s)

HPLC: suitable
gas chromatography (GC): suitable

refractive index

n20/D 1.409 (lit.)
n20/D 1.410

bp

136-138 °C (lit.)

mp

−78 °C (lit.)

density

0.811 g/mL at 25 °C (lit.)

application(s)

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

format

neat

SMILES string

CCCCCO

InChI

1S/C5H12O/c1-2-3-4-5-6/h6H,2-5H2,1H3

InChI key

AMQJEAYHLZJPGS-UHFFFAOYSA-N

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General description

1-Pentanol is a type of alcohol which has been proposed as an alternate for conventional gasoline and diesel fuels.
This substance is listed on the positive list of the EU regulation 10/2011 for plastics intended to come into contact with food.

Find all available reference materials for compounds listed in 10/2011 here

Application

1-Pentanol has been used as a reference standard for the analysis of the analyte in honey samples and in Spanish sparkling wine samples by liquid chromatography coupled with tandem mass spectrometry (LC-MS) and gas chromatography-mass spectrometry (GC-MS), respectively. It may be used as a reference standard for the determination of the analyte in food samples by two-dimensional gas chromatography equipped with flame ionization detector (FID) as well as time-of-flight spectrometry (ToF MS).
Refer to the product′s Certificate of Analysis for more information on a suitable instrument technique. Contact Technical Service for further support.

Signal Word

Danger

Hazard Statements

Hazard Classifications

Acute Tox. 4 Inhalation - Eye Dam. 1 - Flam. Liq. 3 - Skin Irrit. 2 - STOT SE 3

Target Organs

Respiratory system

Storage Class Code

3 - Flammable liquids

WGK

WGK 1

Flash Point(F)

120.2 °F - closed cup

Flash Point(C)

49 °C - closed cup

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Regulatory Listings

Regulatory Listings are mainly provided for chemical products. Only limited information can be provided here for non-chemical products. No entry means none of the components are listed. It is the user’s obligation to ensure the safe and legal use of the product.

FSL

Group 4: Flammable liquids
Type 2 petroleums
Hazardous rank III
Water insoluble liquid

ISHL Indicated Name

Substances Subject to be Indicated Names

ISHL Notified Names

Substances Subject to be Notified Names

JAN Code

77597-BULK-F:
77597-VAR-F:
77597-5ML-F:
77597-1ML-F:
77597-10ML-F:


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Comprehensive two-dimensional gas chromatography of complex samples by using a `reversed-type?column combination: application to food analysis
Adahchour M, et al.
Journal of Chromatography A, 1054(1-2), 47-55 (2004)
Experimental and detailed kinetic modeling study of 1-pentanol oxidation in a JSR and combustion in a bomb.
Togbe C, et al.
Proceedings of the Combustion Institute, 33(1), 367-374 (2011)
Volatile profiles of sparkling wines obtained by three extraction methods and gas chromatography?mass spectrometry (GC?MS) analysis.
Bosch-Fuste J, et al.
Food Chemistry, 105(1), 428-435 (2007)
Acid/base- and anion-controllable organogels formed from a urea-based molecular switch.
Sheng-Yao Hsueh et al.
Angewandte Chemie (International ed. in English), 49(48), 9170-9173 (2010-10-19)
Anthony F Cann et al.
Applied microbiology and biotechnology, 85(4), 893-899 (2009-10-28)
Pentanol isomers such as 2-methyl-1-butanol and 3-methyl-1-butanol are a useful class of chemicals with a potential application as biofuels. They are found as natural by-products of microbial fermentations from amino acid substrates. However, the production titer and yield of the

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