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Merck

50621

Supelco

tert-Butanol

analytical standard

Synonym(e):

2-Methyl-2-propanol, tert-Butylalkohol, Trimethylcarbinol

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About This Item

Lineare Formel:
(CH3)3COH
CAS-Nummer:
Molekulargewicht:
74.12
Beilstein:
906698
EG-Nummer:
MDL-Nummer:
UNSPSC-Code:
41116107
PubChem Substanz-ID:
NACRES:
NA.24

Qualität

analytical standard

Qualitätsniveau

Dampfdichte

2.5 (vs air)

Dampfdruck

31 mmHg ( 20 °C)
44 mmHg ( 26 °C)

Assay

≥99.8% (GC)

Selbstzündungstemp.

896 °F

Haltbarkeit

limited shelf life, expiry date on the label

Expl.-Gr.

8 %

Methode(n)

HPLC: suitable
gas chromatography (GC): suitable

Brechungsindex

n20/D 1.387 (lit.)
n20/D 1.387

bp

83 °C (lit.)

mp (Schmelzpunkt)

23-26 °C (lit.)

Dichte

0.775 g/mL at 25 °C (lit.)

Anwendung(en)

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

Format

neat

SMILES String

CC(C)(C)O

InChI

1S/C4H10O/c1-4(2,3)5/h5H,1-3H3

InChIKey

DKGAVHZHDRPRBM-UHFFFAOYSA-N

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Allgemeine Beschreibung

tert-Butanol is a tertiary alcohol and an isomer of butanol. It is commercially produced from isobutane and is used as a solvent, ethanol denaturant, etc.

Anwendung

The analytical standard can also be used as follows:
  • Detection and quantification of butanol and its isomers in paint samples by a rapid fast gas chromatography-proton transfer reaction-mass spectrometer (FastGC-PTR-MS) method
  • Simultaneous assessment of 121 VOCs emitted from 41 cellulose acetate movie films by proton transfer reaction-time-of-flight-mass spectrometry (PTR-ToF-MS)
  • As an internal standard in the determination of n-butane and its metabolites in the blood, heart, and tissue samples of three autopsy cases that died due to sniffling n-butane and isobutane from portable gas cartridges
  • Headspace-single drop microextraction (HS-SDME) of VOCs from different types of tomato samples for their quantification by gas chromatography-flame ionization detection (GC-FID)

Sonstige Hinweise

Refer to the product′s Certificate of Analysis for more information on a suitable instrument technique. Contact Technical Service for further support.

Empfohlene Produkte

Find a digital Reference Material for this product available on our online platform ChemisTwin® for NMR. You can use this digital equivalent on ChemisTwin® for your sample identity confirmation and compound quantification (with digital external standard). An NMR spectrum of this substance can be viewed and an online comparison against your sample can be performed with a few mouseclicks. Learn more here and start your free trial.

Piktogramme

FlameExclamation mark

Signalwort

Danger

Gefahreneinstufungen

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

Zielorgane

Central nervous system, Respiratory system

Lagerklassenschlüssel

3 - Flammable liquids

WGK

WGK 1

Flammpunkt (°F)

59.0 °F - closed cup

Flammpunkt (°C)

15 °C - closed cup

Persönliche Schutzausrüstung

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


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Analysenzertifikate (COA)

Lot/Batch Number

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Alkylation of p-cresol with tert-butanol catalyzed by heteropoly acid supported on zirconia catalyst
Devassy.MB, et al.
J. Mol. Catal. A: Chem., 210, 125-130 (2004)
Lipase-catalyzed biodiesel production from soybean oil deodorizer distillate with absorbent present in tert-butanol system
Wang L, et al.
Journal of Molecular Catalysis. B, Enzymatic, 43, 29-32 (2006)
Jaime Salazar et al.
European journal of pharmaceutics and biopharmaceutics : official journal of Arbeitsgemeinschaft fur Pharmazeutische Verfahrenstechnik e.V, 81(1), 82-90 (2012-01-12)
Nanosizing is a non-specific approach to improve the oral bioavailability of poorly soluble drugs. The decreased particle size of these compounds results in an increase in surface area. The outcome is an increased rate of dissolution, which can lead to
Arnau Bassegoda et al.
Applied microbiology and biotechnology, 97(19), 8559-8568 (2013-01-22)
Rhodococci are highly adaptable bacteria, capable to degrade or transform a large number of organic compounds, including recalcitrant or toxic products. However, little information is available on the lipases of the genus Rhodococcus, except for LipR, the first lipase isolated
Kohsaku Kawakami
Journal of pharmaceutical sciences, 104(1), 276-279 (2014-11-11)
In our previous study, initiation time of crystallization was shown to be basically expressed as a function of only the reduced temperature, which was a ratio of storage and glass transition temperatures. This conclusion was obtained using quenched glasses with

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