| Identification | More | [Name]
Diethyl ethylmalonate | [CAS]
133-13-1 | [Synonyms]
DEEM
DIETHYL ETHYLAMAONATE
DIETHYL ETHYLMALONATE
ETHYLMALONIC ACID DIETHYL ESTER
2-ethyl-malonicaciddiethylester
Diethyl 2-ethylmalonate
Ethylethylmalonate
Ethylmalonicacid,diethylest
Ethylmalonicester
ethyl-propanedioicaciddiethylester
ethyl-propanedioicacidiethylester
Malonic acid, ethyl-, diethyl ester
Propanedioic acid, ethyl-, diethyl ester
Diethylethylmalonat
Diethyl ethylpropanedioate
Diethyl 2-ethylpropanedioate
2-Ethylpropanedioic acid diethyl ester | [EINECS(EC#)]
205-093-3 | [Molecular Formula]
C9H16O4 | [MDL Number]
MFCD00009167 | [Molecular Weight]
188.22 | [MOL File]
133-13-1.mol |
| Chemical Properties | Back Directory | [Appearance]
CLEAR COLOURLESS LIQUID | [Melting point ]
0°C | [Boiling point ]
75-77 °C/5 mmHg (lit.) | [density ]
1.004 g/mL at 25 °C(lit.)
| [refractive index ]
n20/D 1.416(lit.)
| [Fp ]
191 °F
| [storage temp. ]
Store below +30°C. | [solubility ]
2.87g/l | [form ]
Liquid | [pka]
13.17±0.46(Predicted) | [color ]
Clear colorless | [PH]
4.46 at 24.3℃ and 10g/L | [Water Solubility ]
immiscible | [BRN ]
607635 | [InChI]
1S/C9H16O4/c1-4-7(8(10)12-5-2)9(11)13-6-3/h7H,4-6H2,1-3H3 | [InChIKey]
VQAZCUCWHIIFGE-UHFFFAOYSA-N | [SMILES]
CCOC(=O)C(CC)C(=O)OCC | [LogP]
2.4 at 30℃ and pH7.93 | [CAS DataBase Reference]
133-13-1(CAS DataBase Reference) | [NIST Chemistry Reference]
Propanedioic acid, ethyl-, diethyl ester(133-13-1) | [EPA Substance Registry System]
133-13-1(EPA Substance) |
| Safety Data | Back Directory | [Hazard Codes ]
Xi | [Risk Statements ]
R36/37/38:Irritating to eyes, respiratory system and skin . | [Safety Statements ]
S24/25:Avoid contact with skin and eyes .
S36:Wear suitable protective clothing .
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice . | [WGK Germany ]
2
| [TSCA ]
Yes | [HS Code ]
29171990 | [Storage Class]
10 - Combustible liquids | [Toxicity]
LD50 orally in Rabbit: > 2000 mg/kg LD50 dermal Rat > 2000 mg/kg |
| Hazard Information | Back Directory | [Chemical Properties]
CLEAR COLOURLESS LIQUID | [Uses]
Diethyl Ethylmalonate is used in the synthesis of HIV-1 reverse transcriptase inhibitors. Also used in the preparation of Peloruside A, a novel antimitotic agent used as a potential anti-cancer agent. |
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