| Identification | Back Directory | [Name]
ACETOACETIC ACID N-BUTYL ESTER | [CAS]
591-60-6 | [Synonyms]
FEMA 2176
BUTYL ACETOACETATE
butyl3-oxobutyrate
BUTYL 3-OXOBUTANOATE
N-BUTYL ACETOACETATE
Acetoacetic acid butyl
3-Oxobutyric acid butyl
ACETOACETICN-BUTYLESTER
acetoaceticacid,butylester
3-oxo-butanoicacibutylester
butylesterkyselinyacetoctove
ACETOACETIC ACID N-BUTYL ESTER
3-Oxo-butanoic acidbytyl ester
3-Oxobutanoic acid butyl ester
3-ketobutyric acid butyl ester
Butanoic acid, 3-oxo-, butyl ester | [EINECS(EC#)]
209-722-2 | [Molecular Formula]
C8H14O3 | [MDL Number]
MFCD00059252 | [MOL File]
591-60-6.mol | [Molecular Weight]
158.19 |
| Chemical Properties | Back Directory | [Appearance]
Colorless liquid. Insoluble in water; solu-
ble in alcohol and ether. Combustible.
| [Melting point ]
-35.6°C | [Boiling point ]
223.28°C (rough estimate) | [density ]
0.98 | [FEMA ]
2176 | BUTYL ACETOACETATE | [refractive index ]
1.4250-1.4290 | [Fp ]
85 °C | [form ]
clear liquid | [pka]
10.68±0.46(Predicted) | [color ]
Colorless to Almost colorless | [Odor]
at 10.00 % in dipropylene glycol. sweet fruity brandy fermented | [Odor Type]
fruity | [JECFA Number]
596 | [InChI]
InChI=1S/C8H14O3/c1-3-4-5-11-8(10)6-7(2)9/h3-6H2,1-2H3 | [InChIKey]
REIYHFWZISXFKU-UHFFFAOYSA-N | [SMILES]
C(OCCCC)(=O)CC(=O)C | [LogP]
1.78 | [Uses]
Intermediate in synthesis of metal derivatives,
dyestuffs, pharmaceuticals, flavoring.
| [EPA Substance Registry System]
Butanoic acid, 3-oxo-, butyl ester (591-60-6) |
| Safety Data | Back Directory | [RTECS ]
AK5100000 | [HS Code ]
2918.30.9000 | [Safety Profile]
Mddly toxic by
ingestion. A skin and eye irritant. See also |
| Hazard Information | Back Directory | [Chemical Properties]
Colorless liquid. Insoluble in water; solu-
ble in alcohol and ether. Combustible.
| [Definition]
ChEBI: Butyl acetoacetate is an oxo carboxylic acid. | [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. | [Synthesis Reference(s)]
Journal of the American Chemical Society, 75, p. 5400, 1953 DOI: 10.1021/ja01117a076 |
|
| Company Name: |
Energy Chemical
|
| Tel: |
021-021-58432009 400-005-6266 |
| Website: |
http://www.energy-chemical.com |
|