3-(甲硫基)丁酸乙酯（CAS 233665-96-8）：分子式 C7H14O2S、分子量 162.25。
| CAS号 | 233665-96-8 |
|---|---|
| 分子式 | C7H14O2S |
| 分子量 | 162.25 |
| 沸点 | 101-103 °C (15 mm Hg) |
| LogP | 1.5 |
3-(甲硫基)丁酸乙酯 是一种化工化合物，登记 CAS 号为 233665-96-8，分子式 C7H14O2S（分子量 162.25）。
登记 CAS 号：233665-96-8
其分子式 C7H14O2S 由 7 个碳、14 个氢、2 个氧、1 个硫 组成。
别名/同义词：3-(甲硫基)丁酸乙酯 · ethyl 3-(methylsulfanyl)butanoate
3-(甲硫基)丁酸乙酯 的 CAS 登记号为 233665-96-8。
分子式 C7H14O2S，分子量 162.25。
别名/同义词：3-(甲硫基)丁酸乙酯、ethyl 3-(methylsulfanyl)butanoate。
3-(甲硫基)丁酸乙酯（CAS 233665-96-8）的独立参考数据，整理自公开化学数据库。
| CAS Registry Number | 233665-96-8 |
|---|---|
| PubChem CID | 22213645 |
| Molecular formula | C7H14O2S |
| IUPAC name | ethyl 3-methylsulfanylbutanoate |
| UNII (FDA) | K3KKZ020B3 |
| FEMA number | 3836 |
| JECFA number | 480 |
| Molecular Weight | 162.25 |
|---|---|
| XLogP3 | 1.5 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 5 |
| Exact Mass | 162.07145086 |
| Monoisotopic Mass | 162.07145086 |
| Topological Polar Surface Area | 51.6 |
| Heavy Atom Count | 10 |
| Boiling Point | 101-103 °C (15 mm Hg) |
|---|---|
| Density | 0.880-0.887 |
| Refractive Index | 1.462-1.468 |
233665-96-8; ethyl 3-(methylthio)butyrate; Ethyl 3-methylsulfanylbutanoate; Tropical 3-thiobutyrate; FEMA No. 3836; K3KKZ020B3; Butanoic acid, 3-(methylthio)-, ethyl ester; Ethyl 3-(methylthio)butyrate [FIFH]; ethyl 3-(methylsulfanyl)butanoate; ETHYL 3-(METHYLTHIO)BUTYRATE [FHFI]; Ethyl 3-(methylthio)butyrate (FIFH); UNII-K3KKZ020B3; RefChem:594764; Ethyl 3-(methylthio)butanoate; Ethyl3-(methylthio)butanoate; ethyl 3-methylsulanylbutanoate
| Regulatory & Food Contact | EU Flavoring substances FDA Substance added to food: FLAVORING AGENT OR ADJUVANT Flavoring Agents FLAVOURING_AGENT: Flavouring Agent Savory No safety concern at current levels of intake when used as a flavouring agent |
|---|---|
| GHS notification summary | 50% (1 / 2) |
| GHS notification summary | 50% (1 / 2) |
|---|---|
| Reported hazard statements | H302 (50%), H315 (50%), H317 (50%), H319 (50%) |
This chemical does not meet GHS hazard criteria for 50% (1 of 2) of reports.
H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]
ethyl 3-(methylsulfanyl)butanoate · CAS 233665-96-8 · C7H14O2S. UNII K3KKZ020B3. Boiling Point: 101-103 °C (15 mm Hg); Density: 0.880-0.887; Refractive Index: 1.462-1.468.
数据来源：PubChem / Wikidata；与随货 COA 不一致时以 COA 为准。
English page: ethyl 3-(methylsulfanyl)butanoate