2-(4-methyl-5-thiazolyl)ethyl butyrate (CAS 94159-31-6) — formula C10H15NO2S, molecular weight 213.30.
2-(4-methyl-5-thiazolyl)ethyl butyrate is a chemical compound with CAS registry number 94159-31-6 and molecular formula C10H15NO2S (molecular weight 213.30).
CAS number: 94159-31-6
Its molecular formula C10H15NO2S comprises 10 C, 15 H, 1 N, 2 O, 1 S atoms.
Also known as: 2-(4-methyl-5-thiazolyl)ethyl butyrate · 2-(4-Methylthiazol-5-yl)ethyl butyrate
The CAS registry number of 2-(4-methyl-5-thiazolyl)ethyl butyrate is 94159-31-6.
Molecular formula C10H15NO2S, molecular weight 213.30.
It is also registered under: 2-(4-methyl-5-thiazolyl)ethyl butyrate, 2-(4-Methylthiazol-5-yl)ethyl butyrate.
Public-database records for 2-(4-methyl-5-thiazolyl)ethyl butyrate (CAS 94159-31-6), reproduced here for independent cross-checking.
| GHS 通报统计 | 97.8% (90 / 92) |
|---|
| 法规与食品接触 | 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 通报统计 | 97.8% (90 / 92) |
| 沸点 | 101-107 °C (1 mm Hg) |
|---|---|
| 密度 | 1.106-1.112 |
| 折射率 | 1.496-1.510 |
| CAS 号 | 94159-31-6 |
|---|---|
| PubChem CID | 3023838 |
| 分子式 | C10H15NO2S |
| IUPAC 名称 | 2-(4-methyl-1,3-thiazol-5-yl)ethyl butanoate |
| UNII(FDA) | 27MC9Q333F |
| FEMA 编号 | 4277 |
| JECFA 编号 | 1753 |
2-(4-Methylthiazol-5-yl)ethyl butyrate; 2-(4-methyl-1,3-thiazol-5-yl)ethyl butanoate; sulfuryl butyrate; 2-(4-Methyl-5-thiazolyl)ethyl butanoate; EINECS 303-209-8; UNII-27MC9Q333F; 27MC9Q333F; FEMA NO. 4277; DTXSID40240862; 2-(4-METHYL-5-THIAZOLYL)ETHYL BUTANOATE [FHFI]; BUTANOIC ACID, 2-(4-METHYL-5-THIAZOLYL)ETHYL ESTER; RefChem:84459; DTXCID70163353; 94159-31-6; 2-(4-Methyl-5-thiazolyl)ethyl Butyrate; MFCD09032913
| 分子量 | 213.30 |
|---|---|
| XLogP3 | 2.2 |
| 氢键供体数 | 0 |
| 氢键受体数 | 4 |
| 可旋转键数 | 6 |
| 精确质量 | 213.08234989 |
| 单同位素质量 | 213.08234989 |
| 拓扑极性表面积 | 67.4 |
| 重原子数 | 14 |
| 形式电荷 | 0 |
4-甲基-5-噻唑基乙醇丁酸酯 · CAS 94159-31-6 · C10H15NO2S. UNII 27MC9Q333F. 沸点: 101-107 °C (1 mm Hg); 密度: 1.106-1.112; Refractive Index: 1.496-1.510.
Source: PubChem / Wikidata; the batch COA governs where values differ.
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