A3958312
Ethyl 3-oxohexanoate , 97% , 3249-68-1
Synonym(s):
Ethyl butyrylacetate
CAS NO.：3249-68-1
Empirical Formula: C8H14O3
Molecular Weight: 158.2
MDL number: MFCD00009401
EINECS: 221-835-9
| Pack Size | Price | Stock | Quantity |
| 25G | RMB75.20 | In Stock |
|
| 100G | RMB255.20 | In Stock |
|
| 250g | RMB639.20 | In Stock |
|
| 500G | RMB1040.00 | In Stock |
|
| others | Enquire |
Update time: 2022-07-08
PRODUCT Properties
| Melting point: | -44°C |
| Boiling point: | 104 °C22 mm Hg(lit.) |
| Density | 0.989 g/mL at 25 °C(lit.) |
| FEMA | 3683 | ETHYL 3-OXOHEXANOATE |
| refractive index | n |
| Flash point: | 173 °F |
| storage temp. | Sealed in dry,Room Temperature |
| solubility | soluble in Chloroform, Dichloromethane, Ethyl Acetate, Methanol |
| form | Liquid |
| pka | 10.69±0.46(Predicted) |
| color | Clear colorless |
| Odor | at 100.00 %. sweet green sweaty fruity berry |
| Odor Type | green |
| biological source | synthetic |
| Water Solubility | IMMISCIBLE |
| JECFA Number | 602 |
| BRN | 507689 |
| Stability: | Stable. Incompatible with strong oxidizing agents. |
| InChI | 1S/C8H14O3/c1-3-5-7(9)6-8(10)11-4-2/h3-6H2,1-2H3 |
| InChIKey | KQWWVLVLVYYYDT-UHFFFAOYSA-N |
| SMILES | CCCC(=O)CC(=O)OCC |
| LogP | 1.78 |
| CAS DataBase Reference | 3249-68-1(CAS DataBase Reference) |
| NIST Chemistry Reference | Hexanoic acid, 3-oxo-, ethyl ester(3249-68-1) |
Description and Uses
Ethyl Butyrylacetate is used in the synthesis of pharmaceutical agents such as the anti-HIV agent (+/-)-Calanolide A.Also used in the synthesis of potent and selective polymerase inhibitors.
Safety
| Symbol(GHS) |  GHS06 |
| Signal word | Warning |
| Hazard statements | H227-H301 |
| Precautionary statements | P210e-P280a-P301+P310a-P403+P235-P405-P501a |
| PPE | Eyeshields, Gloves, multi-purpose combination respirator cartridge (US) |
| Safety Statements | 24/25 |
| RIDADR | NA 1993 / PGIII |
| WGK Germany | 3 |
| RTECS | MO8420500 |
| HS Code | 29183000 |
| Storage Class | 10 - Combustible liquids |
