2-(4-甲基噻唑-5-基)乙基己酸酯（CAS 94159-32-7）：分子式 C12H19NO2S、分子量 241.35。
| CAS号 | 94159-32-7 |
|---|---|
| 分子式 | C12H19NO2S |
| 分子量 | 241.35 |
| 沸点 | 143-145 °C (2 mm Hg) |
| LogP | 3.3 |
| 应用领域 | Use Classification: Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes、Flavoring Agents -> JECFA Flavorings Index |
登记用途：Use Classification: Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes、Flavoring Agents -> JECFA Flavorings Index。
2-(4-甲基噻唑-5-基)乙基己酸酯 是一种化工化合物，登记 CAS 号为 94159-32-7，分子式 C12H19NO2S（分子量 241.35）。
登记 CAS 号：94159-32-7
其分子式 C12H19NO2S 由 12 个碳、19 个氢、1 个氮、2 个氧、1 个硫 组成。
别名/同义词：2-(4-甲基噻唑-5-基)乙基己酸酯 · 2-(4-methylthiazol-5-yl)ethyl hexanoate
2-(4-甲基噻唑-5-基)乙基己酸酯 的 CAS 登记号为 94159-32-7。
分子式 C12H19NO2S，分子量 241.35。
别名/同义词：2-(4-甲基噻唑-5-基)乙基己酸酯、2-(4-methylthiazol-5-yl)ethyl hexanoate。
登记用途：Use Classification: Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes、Flavoring Agents -> JECFA Flavorings Index。
2-(4-甲基噻唑-5-基)乙基己酸酯（CAS 94159-32-7）的独立参考数据，整理自公开化学数据库。
| CAS Registry Number | 94159-32-7 |
|---|---|
| PubChem CID | 3023839 |
| Molecular formula | C12H19NO2S |
| IUPAC name | 2-(4-methyl-1,3-thiazol-5-yl)ethyl hexanoate |
| UNII (FDA) | 9J734HMU58 |
| FEMA number | 4279 |
| JECFA number | 1755 |
| Molecular Weight | 241.35 |
|---|---|
| XLogP3 | 3.3 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 8 |
| Exact Mass | 241.11365002 |
| Monoisotopic Mass | 241.11365002 |
| Topological Polar Surface Area | 67.4 |
| Heavy Atom Count | 16 |
| Boiling Point | 143-145 °C (2 mm Hg) |
|---|---|
| Density | 1.065-1.071 |
| Refractive Index | 1.492-1.497 |
94159-32-7; 2-(4-Methyl-5-thiazolyl)ethyl Hexanoate; 2-(4-methyl-1,3-thiazol-5-yl)ethyl hexanoate; sulfuryl hexanoate; UNII-9J734HMU58; 9J734HMU58; EINECS 303-210-3; FEMA NO. 4279; DTXSID00240863; 2-(4-METHYL-5-THIAZOLYL)ETHYL HEXANOATE [FHFI]; HEXANOIC ACID, 2-(4-METHYL-5-THIAZOLYL)ETHYL ESTER; RefChem:84461; DTXCID30163354; 303-210-3; 2-(4-Methylthiazol-5-yl)ethyl hexanoate; MFCD09032914
| Regulatory & Food Contact | FDA Substance added to food: FLAVORING AGENT OR ADJUVANT FLAVOURING_AGENT: Flavouring Agent Flavoring Agents Nuts No safety concern at current levels of intake when used as a flavouring agent TRS 947-JECFA68/ |
|---|---|
| GHS notification summary | 97.8% (89 / 91) |
| GHS notification summary | 97.8% (89 / 91) |
|---|
This chemical does not meet GHS hazard criteria for 97.8% (89 of 91) of all reports.
Reported as not meeting GHS hazard criteria by 89 of 91 companies (only 2.2% companies provided GHS information). For more detailed information, please visit ECHA C&L website.
2-(4-methylthiazol-5-yl)ethyl hexanoate · CAS 94159-32-7 · C12H19NO2S. UNII 9J734HMU58. Boiling Point: 143-145 °C (2 mm Hg); Density: 1.065-1.071; Refractive Index: 1.492-1.497.
数据来源：PubChem / Wikidata；与随货 COA 不一致时以 COA 为准。
English page: 2-(4-methylthiazol-5-yl)ethyl hexanoate