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Merck
CN

01-5300

1-Pentanol

SAJ first grade, ≥97.0%

Synonym(s):

n-Amyl alcohol, Pentyl alcohol

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About This Item

Linear Formula:
CH3(CH2)4OH
CAS Number:
71-41-0
Molecular Weight:
88.15
EC Number:
200-752-1
UNSPSC Code:
12352001
PubChem Substance ID:
329747323
Beilstein/REAXYS Number:
1730975
MDL number:
MFCD00002977

Key Documents

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InChI key

AMQJEAYHLZJPGS-UHFFFAOYSA-N

InChI

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

SMILES string

CCCCCO

grade

SAJ first grade

vapor density

3 (vs air)

vapor pressure

1 mmHg ( 13.6 °C), 1.5 mmHg ( 20 °C)

assay

≥97.0%

form

liquid

expl. lim.

10 %, 100 °F

availability

available only in Japan

refractive index

n20/D 1.409 (lit.)

pH

7

bp

136-138 °C (lit.)

mp

−78 °C (lit.)

density

0.811 g/mL at 25 °C (lit.)

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signalword

Danger

Hazard Classifications

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

target_organs

Respiratory system

Storage Class

3 - Flammable liquids

wgk

WGK 1

flash_point_f

120.2 °F - closed cup

flash_point_c

49 °C - closed cup

ppe

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

Regulatory Information

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Certificates of Analysis (COA)

Lot/Batch Number
A7246
A4241
A6169
A5742
A1743

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Kevin R Hadley et al.
The journal of physical chemistry. B, 114(13), 4590-4599 (2010-03-17)
Developing accurate models of water for use in computer simulations is important for the study of many chemical and biological systems, including lipid bilayer self-assembly. The large temporal and spatial scales needed to study such self-assembly have led to the
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
Anna L Barnette et al.
Langmuir : the ACS journal of surfaces and colloids, 26(21), 16299-16304 (2010-08-26)
The origin and role of tribochemical reaction products formed while sliding silicon oxide surfaces in the presence of adsorbed alcohol molecules in equilibrium with the vapor phase were studied. Wear and friction coefficient studies with varying contact loads and n-pentanol
Young Jae Jeon et al.
Journal of biotechnology, 135(2), 127-133 (2008-04-26)
A thermostable alcohol dehydrogenase (ADH-I) isolated from the potential thermophilic ethanologen Geobacillus thermoglucosidasius strain M10EXG has been characterised. Inverse PCR showed that the gene (adhI) was localised with 3-hexulose-6-phosphate synthase (HPS) and 6-phospho-3 hexuloisomerase (PHI) on its genome. The deduced
Sebastian Höfener et al.
Physical chemistry chemical physics : PCCP, 10(23), 3390-3399 (2008-06-07)
In the recent years, Slater-type geminals (STGs) have been used with great success to expand the first-order wave function in an explicitly-correlated perturbation theory. The present work reports on this theory's implementation in the framework of the Turbomole suite of
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