ChemicalBook--->CAS DataBase List--->13327-56-5

13327-56-5

13327-56-5 Structure

13327-56-5 Structure
IdentificationMore
[Name]

Ethyl 3-methylthiopropionate
[CAS]

13327-56-5
[Synonyms]

3-(methylthio)-propanoic acid ethyl ester
ETHYL 3-(METHYLTHIO)PROPIONATE
ETHYL-BETA-METHYLTHIOPROPIONATE
FEMA 3343
RARECHEM AL BI 0161
3-(methylthio)-propanoicaciethylester
3-(Methylthio)propionic acid ethylester
Ethyl 3-(methylsulfanyl)propanoate
ethyl 3-methylthiopropanoate
Ethyl methylthiopropanoate
Propanoic acid, 3-(methylthio)-, ethyl ester
Propanoicacid,3-(methylthio)-,ethylester
Propionic acid, 3-(methylthio)-, ethyl ester
Propionicacid,3-(methylthio)-,ethylester
Ethyl 3-(methylmercapto)propionate
ETHYL 3-(METHYLTHIO)PROPIONATE 99+% F&
Ethyl 3-(methylthio)propionate, 99+%
ETHYL-3-METYLTHIOPROPIONATE, NATURAL
[EINECS(EC#)]

236-370-7
[Molecular Formula]

C6H12OS
[MDL Number]

MFCD00039900
[Molecular Weight]

132.22
[MOL File]

13327-56-5.mol
Chemical PropertiesBack Directory
[Appearance]

CLEAR COLORLESS TO PALE YELLOWISH LIQUID
[Boiling point ]

197 °C(lit.)
[density ]

1.032 g/mL at 25 °C(lit.)
[FEMA ]

3343
[refractive index ]

n20/D 1.46(lit.)
[Fp ]

177 °F
[storage temp. ]

Keep in dark place,Sealed in dry,Room Temperature
[form ]

clear liquid
[color ]

Colorless to Light yellow
[Specific Gravity]

1.032
[Odor]

at 0.10 % in propylene glycol. sulfury metallic pineapple fruity ripe pulpy tomato
[biological source]

synthetic
[Odor Type]

sulfurous
[JECFA Number]

476
[BRN ]

1748688
[Major Application]

flavors and fragrances
[InChI]

1S/C6H12O2S/c1-3-8-6(7)4-5-9-2/h3-5H2,1-2H3
[InChIKey]

YSNWHRKJEKWJNY-UHFFFAOYSA-N
[SMILES]

CCOC(=O)CCSC
[LogP]

1.57
[CAS DataBase Reference]

13327-56-5(CAS DataBase Reference)
[NIST Chemistry Reference]

3-(Methylthio)propanoic acid ethyl ester(13327-56-5)
[EPA Substance Registry System]

13327-56-5(EPA Substance)
Safety DataBack Directory
[Symbol(GHS) ]

Flame (GHS02)
GHS02
[Signal word ]

Warning
[Hazard statements ]

H227
[Precautionary statements ]

P210e-P280a-P370+P378a-P403+P235-P501a
[Safety Statements ]

S24/25:Avoid contact with skin and eyes .
[RIDADR ]

UN 3334
[WGK Germany ]

3
[TSCA ]

Yes
[HS Code ]

29309090
[Storage Class]

10 - Combustible liquids
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Ethyl acrylate-->Methyl mercaptan-->3,3'-Dithiobis(propionic acid ethyl) ester-->Ethyl-beta-iodopropionate-->3-Methylthiopropionic acid-->Ethanol-->Trimethyl phosphite
[Preparation Products]

Chlorotrimethylsilane-->ethyl 3-(methylsulfonyl)propanoate
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

Ethyl 3-methylthiopropionate(13327-56-5).msds
Hazard InformationBack Directory
[Chemical Properties]

CLEAR COLORLESS TO PALE YELLOWISH LIQUID
[Chemical Properties]

Ethyl-β-methylthiopropionate has a pineapple, citrus odor and fruity, pineapple, passion fruit, malt whiskey flavor.
[Occurrence]

Reported found in melon, pineapple, Parmesan cheeses, beer, grape brandy, cognac, malt whiskey, wine, passion fruit and kiwifruit.
[Uses]

flavors and fragrances
[Definition]

ChEBI: A carboxylic ester obtained by the formal condensation of the carboxy group of 3-(methylthio)propionic acid with ethanol.
[Aroma threshold values]

Detection: 7 ppb. Aroma characteristics at 1.0%: fruity, tinny pineapple, onion sulfurous, musty tomato with metallic ripe and canned notes, savory green with hints of horseradish and tropical notes.
[Taste threshold values]

Taste characteristics at 30 ppm: sulfuraceous, onion garlic, fruity, ripe, pulpy and tomato.
Spectrum DetailBack Directory
[Spectrum Detail]

Ethyl 3-methylthiopropionate(13327-56-5)1HNMR
Ethyl 3-methylthiopropionate(13327-56-5)FT-IR
Ethyl 3-methylthiopropionate(13327-56-5)IR
Well-known Reagent Company Product InformationBack Directory
[Alfa Aesar]

Ethyl 3-(methylthio)propionate, 98%(13327-56-5)
[Sigma Aldrich]

13327-56-5(sigmaaldrich)
[TCI AMERICA]

Ethyl 3-(Methylthio)propionate,>98.0%(GC)(13327-56-5)
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