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294829

Sigma-Aldrich

2-Methyl-1-propanol

anhydrous, 99.5%

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Synonym(s):
Isobutanol, Isobutyl alcohol
Linear Formula:
(CH3)2CHCH2OH
CAS Number:
Molecular Weight:
74.12
Beilstein:
1730878
EC Number:
MDL number:
UNSPSC Code:
12352001
PubChem Substance ID:
NACRES:
NA.21

grade

anhydrous

Quality Level

vapor density

2.55 (vs air)

vapor pressure

8 mmHg ( 20 °C)
8.8 mmHg ( 0 °C)

Assay

99.5%

form

liquid

autoignition temp.

801 °F

expl. lim.

10.6 %

impurities

<0.003% water
<0.005% water (100 mL pkg)

evapn. residue

<0.0005%

refractive index

n20/D 1.396 (lit.)

bp

108 °C (lit.)

mp

−108 °C (lit.)

density

0.803 g/mL at 25 °C (lit.)

SMILES string

CC(C)CO

InChI

1S/C4H10O/c1-4(2)3-5/h4-5H,3H2,1-2H3

InChI key

ZXEKIIBDNHEJCQ-UHFFFAOYSA-N

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Application

Isobutyl alcohol is a water-soluble aliphatic alcohol that is widely used as a solvent in organic synthesis. It is used in the preparation of vanadium phosphate catalysts for the efficient dehydration of xylose into furfural and selective oxidation of n-butane to maleic anhydride.

Signal Word

Danger

Hazard Statements

Hazard Classifications

Eye Dam. 1 - Flam. Liq. 3 - Skin Irrit. 2 - STOT SE 3

Target Organs

Central nervous system, Respiratory system

WGK

WGK 1

Flash Point(F)

82.4 °F

Flash Point(C)

28 °C

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Regulatory Information

危险化学品

Certificates of Analysis (COA)

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Determination of inorganic phosphate.
Martin JB and Doty DM.
Analytical Chemistry, 21(8), 965-967 (1949)
Diffusion in the Three Component Liquid System Methyl Alcohol-n-Propyl Alcohol-Isobutyl Alcohol.
Shuck FO and Toor HL.
The Journal of Physical Chemistry, 67(3), 540-545 (1963)
Arul M Varman et al.
Applied and environmental microbiology, 79(3), 908-914 (2012-11-28)
Global warming and decreasing fossil fuel reserves have prompted great interest in the synthesis of advanced biofuels from renewable resources. In an effort to address these concerns, we performed metabolic engineering of the cyanobacterium Synechocystis sp. strain PCC 6803 to
Pedram Fatehi
Biotechnology progress, 29(2), 297-310 (2013-01-09)
In this review, the recent advancements and technical challenges associated with the production of ethanol, butanol, and isobutanol via bioconversion routes from celluloses of woody materials are reviewed. Physicochemical processes, e.g. steam explosion, seem to be the most viable process
Jan-Karl Guterl et al.
ChemSusChem, 5(11), 2165-2172 (2012-10-23)
The limited supply of fossil resources demands the development of renewable alternatives to petroleum-based products. Here, biobased higher alcohols such as isobutanol are versatile platform molecules for the synthesis of chemical commodities and fuels. Currently, their fermentation-based production is limited

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