Contact us: +91 9550333722 040 - 40102781
Structured search
India
Choose your country
Different countries will display different contents
Try our best to find the right business for you.
My chemicalbook

Welcome back!

HomeProduct name listACETOACETIC ACID N-BUTYL ESTER

ACETOACETIC ACID N-BUTYL ESTER

  • CAS NO.:591-60-6
  • Empirical Formula: C8H14O3
  • Molecular Weight: 158.2
  • MDL number: MFCD00059252
  • EINECS: 209-722-2
  • SAFETY DATA SHEET (SDS)
  • Update Date: 2024-06-06 16:50:07
ACETOACETIC ACID N-BUTYL ESTER Structural

What is ACETOACETIC ACID N-BUTYL ESTER?

Chemical properties

Colorless liquid. Insoluble in water; solu- ble in alcohol and ether. Combustible.

The Uses of ACETOACETIC ACID N-BUTYL ESTER

Intermediate in synthesis of metal derivatives, dyestuffs, pharmaceuticals, flavoring.

Preparation

By heating butyl acetate and sodium or potassium butylate; from ethyl acetoacetate and n-butyl alcohol; by reacting diketene and butyl alcohol in the presence of acetic acid and pyridine.

Definition

ChEBI: Butyl acetoacetate is an oxo carboxylic acid.

Synthesis Reference(s)

Journal of the American Chemical Society, 75, p. 5400, 1953 DOI: 10.1021/ja01117a076

Safety Profile

Mddly toxic by ingestion. A skin and eye irritant. 

Properties of ACETOACETIC ACID N-BUTYL ESTER

Melting point: -35.6°C
Boiling point: 223.28°C (rough estimate)
Density  0.98
refractive index  1.4250-1.4290
FEMA  2176 | BUTYL ACETOACETATE
Flash point: 85 °C
pka 10.68±0.46(Predicted)
form  clear liquid
color  Colorless to Almost colorless
Odor at 10.00 % in dipropylene glycol. sweet fruity brandy fermented
JECFA Number 596
InChI InChI=1S/C8H14O3/c1-3-4-5-11-8(10)6-7(2)9/h3-6H2,1-2H3
EPA Substance Registry System Butanoic acid, 3-oxo-, butyl ester (591-60-6)

Safety information for ACETOACETIC ACID N-BUTYL ESTER

Signal word Warning
GHS Hazard Statements H227:Flammable liquids
Precautionary Statement Codes P210:Keep away from heat/sparks/open flames/hot surfaces. — No smoking.
P280:Wear protective gloves/protective clothing/eye protection/face protection.
P370+P378:In case of fire: Use … for extinction.
P403+P235:Store in a well-ventilated place. Keep cool.
P501:Dispose of contents/container to..…

Computed Descriptors for ACETOACETIC ACID N-BUTYL ESTER

InChIKey REIYHFWZISXFKU-UHFFFAOYSA-N
SMILES C(OCCCC)(=O)CC(=O)C

Related products of tetrahydrofuran

You may like

  • Butyl Acetoacetate CAS 591-60-6
    Butyl Acetoacetate CAS 591-60-6
    591-60-6
    View Details
  • Acetoacetic acid n-butyl ester 95% CAS 591-60-6
    Acetoacetic acid n-butyl ester 95% CAS 591-60-6
    591-60-6
    View Details
  • 1823368-42-8 98%
    1823368-42-8 98%
    1823368-42-8
    View Details
  • 2-(3-(tert-butyl)phenoxy)-2-methylpropanoic acid 1307449-08-6 98%
    2-(3-(tert-butyl)phenoxy)-2-methylpropanoic acid 1307449-08-6 98%
    1307449-08-6
    View Details
  • Ethyl 3-(furan-2-yl)-3-hydroxypropanoate 25408-95-1 98%
    Ethyl 3-(furan-2-yl)-3-hydroxypropanoate 25408-95-1 98%
    25408-95-1
    View Details
  • 2-Chloro-5-fluoro-1-methoxy-3-methylbenzene 98%
    2-Chloro-5-fluoro-1-methoxy-3-methylbenzene 98%
    1805639-70-6
    View Details
  • 1784294-80-9 98%
    1784294-80-9 98%
    1784294-80-9
    View Details
  • Lithium Clavulanate
    Lithium Clavulanate
    61177-44-4
    View Details
Statement: All products displayed on this website are only used for non medical purposes such as industrial applications or scientific research, and cannot be used for clinical diagnosis or treatment of humans or animals. They are not medicinal or edible.