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tert-Butanol

SIAL/471712 - anhydrous, ≥99.5%

Synonym: 2-Methyl-2-propanol; tert-Butyl alcohol; Trimethyl carbinol

CAS Number: 75-65-0
Empirical Formula (Hill Notation): C4H10O
Molecular Weight: 74.12
EC Number: 200-889-7
MDL Number: MFCD00004464
Linear Formula: (CH3)3COH
Product Type: Chemical
Catalog Number PKG Qty. Price Quantity
45-471712-100ML 100 mL
 $80.40
1/EA		 Add To Favorites
Anhydrous, Sureseal
Anhydrous, Sureseal

 

assay ≥99.5%
autoignition temp. 896 °F
bp 83 °C (lit.)
density 0.775 g/mL at 25 °C (lit.)
evapn. residue <0.0003%
expl. lim. 8 %
form solid or liquid
grade anhydrous
impurities <0.005% water
InChI 1S/C4H10O/c1-4(2,3)5/h5H,1-3H3
InChI key DKGAVHZHDRPRBM-UHFFFAOYSA-N
mp 23-26 °C (lit.)
pH 7 (20 °C)
Quality Level 100 
refractive index n20/D 1.387 (lit.)
SMILES string CC(C)(C)O
solubility water: miscible
vapor density 2.5 (vs air)
vapor pressure 31 mmHg ( 20 °C)
  44 mmHg ( 26 °C)
Application:

  • 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 ).
General description: 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.
Packaging: 100 mL in Sure/Seal™
Purity ≥99.5%
bp 83 °C (lit.)
mp 23-26 °C (lit.)
Density 0.775 g/mL at 25 °C (lit.)
Refractive Index n20/D 1.387 (lit.)
UNSPSC 12352001

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