Methyl 2-(methylthio)acetate structure
|
Common Name | Methyl 2-(methylthio)acetate | ||
|---|---|---|---|---|
| CAS Number | 16630-66-3 | Molecular Weight | 120.170 | |
| Density | 1.1±0.1 g/cm3 | Boiling Point | 157.3±0.0 °C at 760 mmHg | |
| Molecular Formula | C4H8O2S | Melting Point | N/A | |
| MSDS | Chinese USA | Flash Point | 60.0±0.0 °C | |
| Symbol |
GHS02 |
Signal Word | Warning | |
Summary: Methyl (Methylthio)acetate, also known as Methyl 2-(methylthio)acetate, has a molecular formula of C4H8O2S and a molecular weight of 120.170. It appears as a colorless to yellow liquid with a boiling point of 157.3°C and a density of 1.1g/cm3. For research-use only, not for medical or clinical usage.
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | Methyl (Methylthio)acetate |
|---|---|
| Synonym | More Synonyms |
This table shows physicochemical parameters including melting point, boiling point, density, solubility and optical rotation. Missing data is marked as N/A.
| Density | 1.1±0.1 g/cm3 |
|---|---|
| Boiling Point | 157.3±0.0 °C at 760 mmHg |
| Molecular Formula | C4H8O2S |
| Molecular Weight | 120.170 |
| Flash Point | 60.0±0.0 °C |
| Exact Mass | 120.024498 |
| PSA | 51.60000 |
| LogP | 0.82 |
| Vapour Pressure | 2.8±0.3 mmHg at 25°C |
| Index of Refraction | 1.454 |
| InChIKey | HZYCAKGEXXKCDM-UHFFFAOYSA-N |
| SMILES | COC(=O)CSC |
| Storage condition | 2-8°C |
This table provides MSDS information including hazard classification, first‑aid, fire‑fighting, spill handling, operation and storage instructions.
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| Symbol |
GHS02 |
|---|---|
| Signal Word | Warning |
| Hazard Statements | H226 |
| Personal Protective Equipment | Eyeshields;full-face respirator (US);Gloves;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter |
| Hazard Codes | F |
| Safety Phrases | S24/25 |
| RIDADR | UN 3272 3/PG 3 |
| WGK Germany | 3 |
| Packaging Group | III |
| Hazard Class | 3.2 |
| HS Code | 2930909090 |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
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Methyl 2-(methy... CAS#:16630-66-3 |
| Literature: Chemische Berichte, , vol. 95, p. 2076 - 2085 |
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Methyl 2-(methy... CAS#:16630-66-3 |
| Literature: Helvetica Chimica Acta, , vol. 54, p. 1880 - 1890 |
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Methyl 2-(methy... CAS#:16630-66-3 |
| Literature: Chemische Berichte, , vol. 107, p. 496 - 501 |
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Methyl 2-(methy... CAS#:16630-66-3 |
| Literature: Journal of the Chemical Society [Section] C: Organic, , p. 2016 - 2022 |
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Methyl 2-(methy... CAS#:16630-66-3 |
| Literature: Journal of Organic Chemistry, , vol. 45, # 9 p. 1686 - 1688 |
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Methyl 2-(methy... CAS#:16630-66-3 |
| Literature: Journal of Organic Chemistry USSR (English Translation), , vol. 13, p. 36 - 42 Zhurnal Organicheskoi Khimii, , vol. 13, p. 40 - 46 |
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Methyl 2-(methy... CAS#:16630-66-3 |
| Literature: Angewandte Chemie, , vol. 93, # 6/7 p. 594 - 595 |
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Methyl 2-(methy... CAS#:16630-66-3 |
| Literature: Angewandte Chemie, , vol. 93, # 6/7 p. 594 - 595 |
This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2930909090 |
|---|---|
| Summary | 2930909090. other organo-sulphur compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0% |
This table lists relevant public references with title, journal and publication metadata for this compound.
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Identification of new strawberry sulfur volatiles and changes during maturation.
J. Agric. Food Chem. 59(4) , 1293-300, (2011) Two Florida strawberry cultivars, 'Strawberry Festival' and 'Florida Radiance', were harvested at five fruit developmental stages (white, half red, three-quarter red, full ripe, and overripe) at four ... |
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Sulfur-containing compounds in the aroma volatiles of melons (Cucumis melo). Wyllie SG and Leach DN.
J. Agric. Food Chem. 40(2) , 253-56, (1992)
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This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| (Methylthio)acetic Acid Methyl Ester |
| Methyl (methylsulfanyl)acetate |
| Methyl (methylthio)acetate |
| methyl 2-methylsulfanylacetate |
| MFCD00039809 |
| Methyl (methylmercapto)acetate |
| Methyl 2-(methylthio)acetate |
| Acetic acid, 2-(methylthio)-, methyl ester |
| EINECS 240-683-4 |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the SMILES notation of Methyl (Methylthio)acetate? |
| A: SMILES notation of Methyl (Methylthio)acetate is COC(=O)CSC. |
| Q: What are the storage conditions for Methyl (Methylthio)acetate? |
| A: Storage conditions for Methyl (Methylthio)acetate: 2-8°C. |
| Q: What is the boiling point of Methyl (Methylthio)acetate? |
| A: Boiling point of Methyl (Methylthio)acetate is 157.3±0.0 °C at 760 mmHg. |
| Q: What is the polar surface area (PSA) of Methyl (Methylthio)acetate? |
| A: Polar surface area (PSA) of Methyl (Methylthio)acetate is 51.60000. |
| Q: What is the safety information for Methyl (Methylthio)acetate? |
| A: Safety information for Methyl (Methylthio)acetate: S24/25. |
| Q: What is the InChIKey of Methyl (Methylthio)acetate? |
| A: InChIKey of Methyl (Methylthio)acetate is HZYCAKGEXXKCDM-UHFFFAOYSA-N. |
| Q: What is the molecular weight of Methyl (Methylthio)acetate? |
| A: Molecular weight of Methyl (Methylthio)acetate is 120.170. |
| Q: What is the English name of Methyl (Methylthio)acetate? |
| A: The English name of Methyl (Methylthio)acetate is Methyl (Methylthio)acetate. |
| Q: What English synonyms does Methyl (Methylthio)acetate have? |
| A: English synonyms of Methyl (Methylthio)acetate: (Methylthio)acetic Acid Methyl Ester, Methyl (methylsulfanyl)acetate, Methyl (methylthio)acetate, methyl 2-methylsulfanylacetate, MFCD00039809, Methyl (methylmercapto)acetate, Methyl 2-(methylthio)acetate, Acetic acid, 2-(methylthio)-, methyl ester, EINECS 240-683-4. |
| Q: What is the molecular formula of Methyl (Methylthio)acetate? |
| A: Molecular formula of Methyl (Methylthio)acetate is C4H8O2S. |
This table lists manufacturers and suppliers of this compound, including vendor names and product supply reference information.
| Shanghai Nianxing Industrial Co., Ltd |
| Dayang Chem (Hangzhou) Co., Ltd. |
| Zhongshan Xingrui Chemical Co. , Ltd. |