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Key Documents

471712

Sigma-Aldrich

tert-Butanol

anhydrous, ≥99.5%

Sinonimo/i:

2-Methyl-2-propanol, tert-Butyl alcohol, Trimethyl carbinol

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About This Item

Formula condensata:
(CH3)3COH
Numero CAS:
Peso molecolare:
74.12
Beilstein:
906698
Numero CE:
Numero MDL:
Codice UNSPSC:
12352001
ID PubChem:
NACRES:
NA.21

Grado

anhydrous

Livello qualitativo

Densità del vapore

2.5 (vs air)

Tensione di vapore

31 mmHg ( 20 °C)
44 mmHg ( 26 °C)

Saggio

≥99.5%

Forma fisica

solid or liquid

Temp. autoaccensione

896 °F

Limite di esplosione

8 %

Impurezze

<0.005% water

Residuo dopo evaporazione

<0.0003%

Indice di rifrazione

n20/D 1.387 (lit.)

pH

7 (20 °C)

P. eboll.

83 °C (lit.)

Punto di fusione

23-26 °C (lit.)

Solubilità

water: miscible

Densità

0.775 g/mL at 25 °C (lit.)

Stringa SMILE

CC(C)(C)O

InChI

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

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Descrizione generale

tert-Butanol (tBA) is a tertiary alcohol. It undergoes dehydration by reactive distillation in the presence of solid acid catalyst to form isobutylene with high selectivity. Lipase-mediated alcoholysis of soybean oil deodorizer distillate (SODD) has been conducted in tBA (as reaction medium) to generate biodiesel. Formation of 2-tert-butyl-p-cresol (TBC), 2,6-di-tert-butyl-p-cresol (DTBC) and tert-butyl-p-tolyl ether has been reported when p-cresol undergoes butylation by tBA in the presence of 12-tungstophosphoric acid supported on zirconia (TPA/ZrO2) catalyst. The interaction behavior of tBA on the Si (001)-(2×1) surface has been assessed by using the ab-initio density functional theory (DFT) based on pseudopotential approach.

Applicazioni


  • Synthesis of Ribose - Oleic Acid Esters in the Presence- and Absence of Candida antarctica Lipase B.: This study investigates the synthesis of ribose-oleic acid esters using tert-Butanol as a solvent, both with and without the presence of Candida antarctica Lipase B. The research explores the efficiency and effectiveness of the enzyme-catalyzed process, highlighting the impact of tert-Butanol on the synthesis reaction. The findings contribute to the understanding of esterification processes in analytical chemistry and have potential applications in developing new synthetic methods (Çetinkaya et al., 2020).

Pittogrammi

FlameExclamation mark

Avvertenze

Danger

Indicazioni di pericolo

Classi di pericolo

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

Organi bersaglio

Central nervous system, Respiratory system

Codice della classe di stoccaggio

3 - Flammable liquids

Classe di pericolosità dell'acqua (WGK)

WGK 1

Punto d’infiammabilità (°F)

59.0 °F - closed cup

Punto d’infiammabilità (°C)

15 °C - closed cup

Dispositivi di protezione individuale

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


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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(1), 29-32 (2006)
Atomic and electronic properties of tert-butanol on the Si (001)-(2?1) surface.
Kaderoglu C, et al.
European Physical Journal B: Condensed Matter and Complex Systems, 76(3), 359-363 (2010)
Tert-butanol dehydration to isobutylene via reactive distillation.
Knifton JF, et al.
Catalysis Letters, 73(1), 55-57 (2001)
Alkylation of p-cresol with tert-butanol catalyzed by heteropoly acid supported on zirconia catalyst.
Devassy BM, et al.
J. Mol. Catal. A: Chem., 210(1), 125-130 (2004)
Zaida Lentini et al.
Frontiers in plant science, 11, 522-522 (2020-05-28)
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