ChemicalBook--->CAS DataBase List--->16630-55-0

16630-55-0

16630-55-0 Structure

16630-55-0 Structure
IdentificationBack Directory
[Name]

3-(Methylthio)propyl acetate
[CAS]

16630-55-0
[Synonyms]

FEMA 3883
Einecs 240-679-2
methionyl acetate
methionol acetate
3-MEHTYLTHIO PROPYL ACETATE
3-(METHYLTHIO)PROPYL ACETATE
3-ACETOXYPROPYL METHYL SULFIDE
3-(Methylthio)propylAcetate>
3-(METHYLTHIO)-1-PROPANOACETATE
3-(Methylsulfanyl)propyl acetate
3-(methylthio)-1-Propanol acetate
3-(Methylmercapto)-propyl acetate
1-Propanol, 3-(methylthio)-, acetate
Acetic acid 3-(methylthio)propyl ester
1-Propanol, 3-(methylthio)-, 1-acetate
3-(Methylthio)propyl acetate USP/EP/BP
[EINECS(EC#)]

240-679-2
[Molecular Formula]

C6H12O2S
[MDL Number]

MFCD00053113
[MOL File]

16630-55-0.mol
[Molecular Weight]

148.22
Chemical PropertiesBack Directory
[Boiling point ]

96°C/14mmHg(lit.)
[density ]

1.041 g/cm3
[FEMA ]

3883 | 3-(METHYLTHIO)PROPYL ACETATE
[refractive index ]

1.4610-1.4650
[form ]

clear liquid
[color ]

Colorless to Almost colorless
[Odor]

at 0.10 % in propylene glycol. herbal mushroom cabbage asparagus potato cheesy
[Odor Type]

sulfurous
[JECFA Number]

478
[InChI]

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

LPZQTNIAYMRVMF-UHFFFAOYSA-N
[SMILES]

C(OC(=O)C)CCSC
[LogP]

1.30
[NIST Chemistry Reference]

1-Propanol, 3-(methylthio)-, acetate(16630-55-0)
Safety DataBack Directory
[HS Code ]

2930909899
Hazard InformationBack Directory
[Occurrence]

Reported found in apple, melon, pineappple, beer, malt whiskey and white wine.
[Uses]

3-(Methylthio)propyl Acetate is liquid cleaning compound with optimized scent. Also, is perfume compound comprising fragrance modulator compounds and 1-Aza-3,7-dioxabicyclo[3.3.0]octane compounds for increasing and prolonging the intensity of fragrance.
[Definition]

ChEBI: 3-methylthiopropyl acetate is an acetate ester obtained by the formal condensation of the hydroxy group of 3-(methylsulfanyl)propan-1-ol with acetic acid. It has a role as a metabolite. It is an acetate ester and a methyl sulfide. It is functionally related to a 3-methylthiopropanol.
[Aroma threshold values]

Detection: 30 ppb
Spectrum DetailBack Directory
[Spectrum Detail]

3-(Methylthio)propyl acetate(16630-55-0)1HNMR
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