Methyl 3-methylthiopropionate
Synonym(s):Methyl 3-(methylmercapto)propionate
- CAS NO.:13532-18-8
- Empirical Formula: C5H10O2S
- Molecular Weight: 134.2
- MDL number: MFCD00008565
- EINECS: 236-883-6
- SAFETY DATA SHEET (SDS)
- Update Date: 2024-12-18 19:01:08
What is Methyl 3-methylthiopropionate?
Description
Methyl 3-methylthiopropionate has an extremely powerful, penetrating, sweet odor. It is onion-like at high concentrations with a sweet pineapple flavor at high dilutions. Obtained in 84% yields by reacting CH2 = CH — CO — OCH3 with CH3SH; the corresponding acid also has been synthesized.
Chemical properties
CLEAR COLOURLESS LIQUID
Chemical properties
Methyl-3-methylthiopropionate has an extremely powerful, penetrating, sweet odor, onion-like at high concentrations and a sweet pineapple flavor at high dilutions.
Occurrence
Reported found in pineapple fruit, white wine, melon and naranjilla fruit.
The Uses of Methyl 3-methylthiopropionate
Methyl 3-(methylthio)propionate was used to prepare 3-methiolpropionate(MMPA) to study the demethylation of Dimethylsulfoniopropionate and MMPA to 3-mercaptopropionate by aerobic marine bacterium. Methyl 3-(methylthio)propionate was used to prepare 3-(Methylthio)propionic acid to examine the methionine catabolism by Lactococci by 13C Nuclear Magnetic Resonance and Gas Chromatography.
Definition
ChEBI: Methyl 3-(methylthio)propanoate is a carboxylic ester.
Aroma threshold values
Detection: 180 ppb
Taste threshold values
Taste characteristics at 5 ppm: vegetative, radish and horseradish.
General Description
Methyl 3-(methylthio)propionate is the major ester present in the flavour profile of juices made from fresh-cut pineapple fruits.
Synthesis
Obtained in 84% yields by reacting with CH3SH; the corresponding acid also has been synthesized.
Properties of Methyl 3-methylthiopropionate
Boiling point: | 74-75 °C/13 mmHg (lit.) |
Density | 1.077 g/mL at 25 °C (lit.) |
refractive index | n |
FEMA | 2720 | METHYL 3-METHYLTHIOPROPIONATE |
Flash point: | 162 °F |
solubility | Chloroform (Soluble), Methanol (Sparingly) |
form | Liquid |
color | Clear colorless |
Odor | at 0.10 % in propylene glycol. sulfurous vegetable onion sweet garlic tomato |
JECFA Number | 472 |
BRN | 1745077 |
CAS DataBase Reference | 13532-18-8(CAS DataBase Reference) |
NIST Chemistry Reference | 3-(Methylthio)propanoic acid methyl ester(13532-18-8) |
EPA Substance Registry System | Methyl-3-(methylthio)propionate (13532-18-8) |
Safety information for Methyl 3-methylthiopropionate
Signal word | Warning |
Pictogram(s) |
Flame Flammables GHS02 |
GHS Hazard Statements |
H227:Flammable liquids |
Precautionary Statement Codes |
P210:Keep away from heat/sparks/open flames/hot surfaces. — No smoking. P280:Wear protective gloves/protective clothing/eye protection/face protection. P370+P378:In case of fire: Use … for extinction. P403+P235:Store in a well-ventilated place. Keep cool. P501:Dispose of contents/container to..… |
Computed Descriptors for Methyl 3-methylthiopropionate
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