Isobutyl butyrate

Available forms:Colorless liquid

pd_proNo:464064-2ec0c2b8-55dd-40b0-ace0-1b09f1ed1fb4

pd_productuse:

Contact us

Detailed introduction

Quality Factory Hot Selling Isobutyl butyrate 539-90-2 with Fast Shipping

  • Molecular Formula:C8H16O2
  • Molecular Weight:144.214
  • Appearance/Colour:Colorless liquid 
  • Vapor Pressure:2.91mmHg at 25°C 
  • Melting Point:-88.07°C (estimate) 
  • Refractive Index:n20/D 1.403(lit.)  
  • Boiling Point:156.3 °C at 760 mmHg 
  • Flash Point:45.6 °C 
  • PSA:26.30000 
  • Density:0.876 g/cm3 
  • LogP:1.98570 

Isobutyl butyrate(Cas 539-90-2) Usage

Usee

Isobutyl butyrate is a metabolite of Rifampicin, a Rifamycin antibiotic.

Preparation

By esterification of butyric acid with isobutyl alcohol in the presence of concentrated H2SO4, or by enzymatic action of hog pancreas on a mixture of isobutyl alcohol and butyric acid in the absence of water.

Synthesis Reference(s)

The Journal of Organic Chemistry, 56, p. 5307, 1991 DOI: 10.1021/jo00018a019

Safety Profile

Mdly toxic by ingestion and intraduodenal routes. A skin irritant. See also ESTERS. When heated to decomposition it emits acrid smoke and irritating fumes.

Definition

ChEBI: A butyrate ester resulting from the formal condensation of butanoic acid with isobutanol. It is used as a food flavour ingredient for apple, banana, peach and pinapple flavours in ice cream and confectionery.

Taste threshold values

Taste characteristics at 20 ppm: sweet, fruity, pineapple, apple, bubble gum and tutti-frutti. Natural occurrence: Reported found in apricot, banana, apple, strawberry, blue and Gruyere cheeses, cognac, port wine, rum, honey, olive, passion fruit, plum, beans, mushrooms, mango, apple brandy, quince, cherimoya, kiwifruit and Chinese quince pee

General Description

Isobutyl butyrate is an aliphatic ester that can be used as a food flavoring agent. It is one of the volatile flavor compounds produced in ripening bananas.

InChI:InChI=1/C8H16O2/c1-4-5-8(9)10-6-7(2)3/h7H,4-6H2,1-3H3

539-90-2 Relevant articles

Total Synthesis and Functional Evaluation of Fourteen Derivatives of Lysocin E: Importance of Cationic, Hydrophobic, and Aromatic Moieties for Antibacterial Activity

Kaji, Takuya,Murai, Motoki,Itoh, Hiroaki,Yasukawa, Jyunichiro,Hamamoto, Hiroshi,Sekimizu, Kazuhisa,Inoue, Masayuki

supporting information, p. 16912 - 16919 (2016/11/16)

Lysocin E (1) is a structurally complex ...

Ultrasound technology and molecular sieves improve the thermodynamically controlled esterification of butyric acid mediated by immobilized lipase from Rhizomucor miehei

Fallavena, Lucas P.,Antunes, Fabio H. F.,Alves, Joana S.,Paludo, Natalia,Ayub, Marco A. Z.,Fernandez-Lafuente, Roberto,Rodrigues, Rafael C.

, p. 8675 - 8681 (2014/03/21)

In this research, the effects of ultraso...

The Mechanism of the β-Acyloxyalkyl Radical Rearrangement: Kinetic and 18O-Labelling Studies

Beckwith, Athelstan L. J.,Duggan, Peter J.

, p. 1777 - 1783 (2007/10/02)

Experiments with 18O-enriched substrates...

Novel Template Effects of Distannoxane Catalysts in Highly Efficient Transesterification and Esterification

Otera, Junzo,Dan-oh, Nobushisa,Nozaki, Hitosi

, p. 5307 - 5311 (2007/10/02)

The transesterification of carboxylic es...

539-90-2 Process route

2-methyl-propan-1-ol
78-83-1

2-methyl-propan-1-ol

butyric acid
107-92-6

butyric acid

isobutyl n-butyrate
539-90-2

isobutyl n-butyrate

Conditions
Conditions Yield
With immobilized lipase from Rhizomucor miehei; In hexane; at 45 ℃; for 2.5h; Solvent; Concentration; Temperature; Kinetics; Sonication; Molecular sieve; Enzymatic reaction;
96%
With zirconium(IV) oxide; at 270 - 280 ℃;
With sulfuric acid; benzene;
With sulfuric acid;
bei der Einw. von Schweinepankreaspulver;
1-Hydroxy-3-(isothiocyanato)-tetrabutyldistannoxane; at 80 ℃;
100 % Chromat.
2-methyl-propan-1-ol
78-83-1

2-methyl-propan-1-ol

butyryl chloride
141-75-3

butyryl chloride

isobutyl n-butyrate
539-90-2

isobutyl n-butyrate

Conditions
Conditions Yield
With pyridine;

539-90-2 Upstream products

  • 106-31-0
    106-31-0

    butanoic acid anhydride

  • 5674-02-2
    5674-02-2

    2-methylpropylmagnesium chloride

  • 78-83-1
    78-83-1

    2-methyl-propan-1-ol

  • 107-92-6
    107-92-6

    butyric acid

539-90-2 Downstream products

  • 109-74-0
    109-74-0

    propyl cyanide

  • 541-35-5
    541-35-5

    butanamide

  • 76754-50-2
    76754-50-2

    2-methylpropyl (Z)-but-2-enoate

  • 73545-15-0
    73545-15-0

    isobutyl trans-crotonate

CONTACT US

For inquiries About Our Products, Please Leave Your E-Mail To Us And We will Contact You Within 24 Hours.

*Product Name
CasNo
Purity
Quantity
Company name
*Email
*Other Description
*Verification code:
Submit
Purchase Posted Successfully, our staff will contact you within 24 hours.