Diethylmalonate , 10mMinDMSO , 105-53-3
Synonym(s):
Diethyl malonate;Ethyl malonate, Malonic acid diethyl ester;Malonic acid diethyl ester
CAS NO.：105-53-3
Empirical Formula: C7H12O4
Molecular Weight: 160.17
MDL number: MFCD00009195
EINECS: 203-305-9
| Pack Size | Price | Stock | Quantity |
| 1ml | RMB159.20 | In Stock |
|
| others | Enquire |
PRODUCT Properties
| Melting point: | -51--50 °C (lit.) |
| Boiling point: | 199 °C (lit.) |
| Density | 1.055 g/mL at 25 °C (lit.) |
| vapor density | 5.52 (vs air) |
| vapor pressure | 1 mm Hg ( 40 °C) |
| refractive index | n |
| FEMA | 2375 | DIETHYL MALONATE |
| Flash point: | 212 °F |
| storage temp. | Store below +30°C. |
| solubility | 20.8g/l (External MSDS) |
| pka | 13.5(at 25℃) |
| form | Liquid |
| color | colourless liquid |
| Odor | Sweet ester odor |
| explosive limit | 0.8-12.8%(V) |
| Odor Type | fruity |
| Water Solubility | Miscible with ethyl alcohol, ether, chloroform and benzene. Slightly miscible with water. |
| Merck | 14,3823 |
| JECFA Number | 614 |
| BRN | 774687 |
| Dielectric constant | 7.9（21℃） |
| Stability: | Stable. Combustible. Incompatible with strong oxidizing agents, |
| InChIKey | IYXGSMUGOJNHAZ-UHFFFAOYSA-N |
| LogP | 0.96 at 20℃ |
| CAS DataBase Reference | 105-53-3(CAS DataBase Reference) |
| NIST Chemistry Reference | Propanedioic acid, diethyl ester(105-53-3) |
| EPA Substance Registry System | Diethyl malonate (105-53-3) |
Description and Uses
Diethyl malonate is a diester derivative of malonic acid, a dicarboxylic acid with two carboxyl groups (-COO-) separated by one methylene group (-CH2-). Diethyl malonate is formed by the replacement of the hydroxyl groups (-OH) of malonic acid with ethoxy groups (-OCH2CH3). The hydrogen atoms on the methylene carbon between the two carboxyl groups make this compound acidic. Because of its unique structure, diethyl malonate is reactive and functions as a reagent for organic synthesis and to make products such as barbiturates, pigments, and agrochemicals. Volatile esters are known to have fruity scents and are often used as fragrances and flavorings. Diethyl malonate is a volatile diester that occurs naturally in fruits such as grapes, strawberries, guava, melon, pineapple, and blackberries.
Diethyl Malonate occurs naturally in grapes and strawberries. It is used in the preparation of barbiturates, artificial flavourings, vitamin B1, and vitamin B6 as well as in perfumes.
Safety
| Symbol(GHS) |  GHS07 |
| Signal word | Warning |
| Hazard statements | H319 |
| Precautionary statements | P264-P280-P305+P351+P338-P337+P313 |
| Hazard Codes | Xi |
| Risk Statements | 36/37/38-36 |
| Safety Statements | 24/25-26 |
| WGK Germany | 1 |
| RTECS | OO0700000 |
| Autoignition Temperature | 435 °C DIN 51794 |
| Hazard Note | Irritant |
| TSCA | Yes |
| HS Code | 29171910 |
| Hazardous Substances Data | 105-53-3(Hazardous Substances Data) |
| Toxicity | LD50 orally in Rabbit: 15720 mg/kg LD50 dermal Rabbit > 16000 mg/kg |
