-
Name
Dimethyl allylmalonate
- EINECS 255-017-8
- CAS No. 40637-56-7
- Article Data84
- CAS DataBase
- Density 1.056 g/cm3
- Solubility
- Melting Point <-80 °C
- Formula C8H12O4
- Boiling Point 165.239 °C at 760 mmHg
- Molecular Weight 172.181
- Flash Point 67.259 °C
- Transport Information
- Appearance
- Safety 23-24/25
- Risk Codes 1772822
-
Molecular Structure
- Hazard Symbols
- Synonyms Propanedioicacid, 2-propenyl-, dimethyl ester (9CI);4,4-Bis(carboxymethoxy)-1-butene;Dimethyl 2-(2-propenyl)malonate;Dimethyl 2-(prop-2-enyl)propane-1,3-dioate;
- PSA 52.60000
- LogP 0.52470
Dimethyl allylmalonate Chemical Properties
Molecular Structure of Dimethyl allylmalonate (CAS No.40637-56-7):
Molecular Formula: C8H12O4
Molecular Weight: 172.1785
CAS No: 40637-56-7
H bond acceptors: 4
H bond donors: 0
Freely Rotating Bonds: 6
Polar Surface Area: 52.6 Å2
Index of Refraction: 1.432
Molar Refractivity: 42.34 cm3
Molar Volume: 163 cm3
Surface Tension: 31.5 dyne/cm
Density: 1.056 g/cm3
Flash Point: 67.3 °C
Enthalpy of Vaporization: 40.17 kJ/mol
Boiling Point: 165.2 °C at 760 mmHg
Vapour Pressure: 1.89 mmHg at 25°C
IUPAC Name: Dimethyl 2-prop-2-enylpropanedioate
InChI: InChI=1/C8H12O4/c1-4-5-6(7(9)11-2)8(10)12-3/h4,6H,1,5H2,2-3H3
InChIKey: VZNFVLWVVHHMBG-UHFFFAOYAY
Std. InChI: InChI=1S/C8H12O4/c1-4-5-6(7(9)11-2)8(10)12-3/h4,6H,1,5H2,2-3H3
Std. InChIKey: VZNFVLWVVHHMBG-UHFFFAOYSA-N
Product Categories: C8 to C9;Carbonyl Compounds;Esters
Dimethyl allylmalonate Safety Profile
Safety Statements: 23-24/25
S23:Do not breathe vapour.
S24/25:Avoid contact with skin and eyes.
WGK Germany: 3
Dimethyl allylmalonate Specification
Dimethyl allylmalonate (CAS No.40637-56-7), its synonyms are Propanedioic acid, 2-(2-propen-1-yl)-, dimethyl ester ; Propanedioic acid, 2-propenyl-, dimethyl ester ; 2-Propenylpropanedioic acid dimethyl ester ; Allylmalonic acid dimethyl ester .
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