Methyl 3-(methylthio)propionate - CAS 13532-18-8
Catalog: |
BB008139 |
Product Name: |
Methyl 3-(methylthio)propionate |
CAS: |
13532-18-8 |
Synonyms: |
methyl 3-methylsulfanylpropanoate |
IUPAC Name: | methyl 3-methylsulfanylpropanoate |
Description: | Methyl 3-(methylthio)propionate (CAS# 13532-18-8) is a useful research chemical compound. |
Molecular Weight: | 134.20 |
Molecular Formula: | C5H10O2S |
Canonical SMILES: | COC(=O)CCSC |
InChI: | InChI=1S/C5H10O2S/c1-7-5(6)3-4-8-2/h3-4H2,1-2H3 |
InChI Key: | DMMJVMYCBULSIS-UHFFFAOYSA-N |
Boiling Point: | 74-75 °C (13 torr) |
Purity: | 99 % |
Density: | 1.07 g/cm3 |
Solubility: | very slightly |
Appearance: | Clear colourless liquid |
Storage: | Keep away from heat, sparks, and flame. Keep away from sources of ignition. Keep container closed when not in use. Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances. |
MDL: | MFCD00008565 |
LogP: | 0.91250 |
GHS Hazard Statement: | H302 (97.37%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P264, P270, P301+P312, P330, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-113511991-A | Synthesis method for thioatherification and thiocarbonylation of halogenated alkane | 20210708 |
WO-2021151731-A1 | Method for conducting finishing hydrodesulphurisation in the presence of a catalyst obtained by additivation | 20200128 |
WO-2021121979-A1 | Method for producing an active electrode layer for electrochemical reduction reactions by impregnation in a molten medium | 20191217 |
WO-2021121981-A1 | Method for preparing a hydrotreating and/or hydrocracking catalyst by co-mulling in a melt, and catalyst obtained in the use thereof | 20191217 |
WO-2021121982-A1 | Process for the preparation of a hydrotreating and/or hydrocracking catalyst by impregnation in a melted medium, catalyst obtained, and use thereof | 20191217 |
PMID | Publication Date | Title | Journal |
22837701 | 20120101 | Aroma volatile compounds from two fresh pineapple varieties in China | International journal of molecular sciences |
21280634 | 20110223 | Identification of new strawberry sulfur volatiles and changes during maturation | Journal of agricultural and food chemistry |
11329675 | 20010501 | The formation of malodorous dimethyl oligosulphides in treated groundwater: the role of biofilms and potential precursors | Water research |
Complexity: | 72.8 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 134.04015073 |
Formal Charge: | 0 |
Heavy Atom Count: | 8 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 134.04015073 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 51.6 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.7 |
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