3-(Methylthio)propyl acetate

Base Information

• Chemical Name: 3-(Methylthio)propyl acetate
• CAS No.: 16630-55-0
• Molecular Formula: C6H12O2S
• Molecular Weight: 148.226
• Hs Code.: 2930909899
• European Community (EC) Number: 240-679-2
• UNII: IGN6YR3CJE
• DSSTox Substance ID: DTXSID90168087
• Nikkaji Number: J318.267C
• Wikidata: Q27159486
• Metabolomics Workbench ID: 45056
• Mol file: 16630-55-0.mol

Synonyms:3-(Methylthio)propyl acetate;16630-55-0;3-Methylthiopropyl acetate;3-methylsulfanylpropyl acetate;3-(methylsulfanyl)propyl acetate;1-Propanol, 3-(methylthio)-, acetate;IGN6YR3CJE;UNII-IGN6YR3CJE;Acetic Acid 3-(Methylthio)propyl Ester;EINECS 240-679-2;1-Propanol, 3-(methylthio)-, 1-acetate;3-Mehtylthio propyl acetate;3-Methylthio propyl acetate;SCHEMBL3505159;FEMA NO. 3883;CHEBI:87281;FEMA 3883;DTXSID90168087;MFCD00053113;3-ACETOXYPROPYL METHYL SULFIDE;AKOS006271814;AS-15965;3-(METHYLTHIO)PROPYL ACETATE [FHFI];CS-0138138;FT-0658130;M2386;D91595;A810713;J-640423;J-800452;Q27159486

Chemical Property of 3-(Methylthio)propyl acetate

Chemical Property:

• Vapor Pressure: 0.247mmHg at 25°C
• Refractive Index: 1.458
• Boiling Point: 205.666 °C at 760 mmHg
• Flash Point: 84.544 °C
• PSA: 51.60000
• Density: 1.022 g/cm³
• LogP: 1.30260
• XLogP3: 1.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 5
• Exact Mass: 148.05580079
• Heavy Atom Count: 9
• Complexity: 83.1

Purity/Quality:

99% ^*data from raw suppliers

3-Methylthiopropyl acetate ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=O)OCCCSC
• 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.

Technology Process of 3-(Methylthio)propyl acetate

There total 1 articles about 3-(Methylthio)propyl acetate which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

→ 3-(methylthio)propyl acetate (16630-55-0)

Guidance literature:

entspr. Alkohol, Essigsaeure;