S-(2,5-二甲基-3-呋喃基)硫代乙酸酯(CAS 55764-22-2):分子式 C8H10O2S、分子量 170.23。
| CAS号 | 55764-22-2 |
|---|---|
| 分子式 | C8H10O2S |
| 分子量 | 170.23 |
| 沸点 | 230 °C |
| LogP | 2.1 |
| 应用领域 | Use Classification: Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes、Flavoring Agents -> JECFA Flavorings Index、Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes、General Manufacturing Information: Ethanethioic acid、S-(2、5-dimethyl-3-furanyl) ester: ACTIVE |
登记用途:Use Classification: Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes、Flavoring Agents -> JECFA Flavorings Index、Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes、General Manufacturing Information: Ethanethioic acid、S-(2、5-dimethyl-3-furanyl) ester: ACTIVE。
S-(2,5-二甲基-3-呋喃基)硫代乙酸酯 是一种化工化合物,登记 CAS 号为 55764-22-2,分子式 C8H10O2S(分子量 170.23)。
登记 CAS 号:55764-22-2
其分子式 C8H10O2S 由 8 个碳、10 个氢、2 个氧、1 个硫 组成。
别名/同义词:S-(2,5-二甲基-3-呋喃基)硫代乙酸酯 · 2,5-Dimethyl-3-thioacetoxyfuran
S-(2,5-二甲基-3-呋喃基)硫代乙酸酯 的 CAS 登记号为 55764-22-2。
分子式 C8H10O2S,分子量 170.23。
别名/同义词:S-(2,5-二甲基-3-呋喃基)硫代乙酸酯、2,5-Dimethyl-3-thioacetoxyfuran。
登记用途:Use Classification: Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes、Flavoring Agents -> JECFA Flavorings Index、Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes、General Manufacturing Information: Ethanethioic acid、S-(2、5-dimethyl-3-furanyl) ester: ACTIVE。
S-(2,5-二甲基-3-呋喃基)硫代乙酸酯(CAS 55764-22-2)的独立参考数据,整理自公开化学数据库。
| CAS Registry Number | 55764-22-2 |
|---|---|
| PubChem CID | 108764 |
| Molecular formula | C8H10O2S |
| Molecular weight | 170.04 g/mol |
| IUPAC name | S-(2,5-dimethylfuran-3-yl) ethanethioate |
| InChIKey | LULNJORVPBVGRB-UHFFFAOYSA-N |
| UNII (FDA) | 6FAQ96BE1Q |
| ChEBI ID | CHEBI:173776 |
| FEMA number | 4034 |
| JECFA number | 1523 |
| Molecular Weight | 170.23 |
|---|---|
| XLogP3 | 2.1 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 2 |
| Exact Mass | 170.04015073 |
| Monoisotopic Mass | 170.04015073 |
| Topological Polar Surface Area | 55.5 |
| Heavy Atom Count | 11 |
| Boiling Point | 230 °C |
|---|---|
| Density | 1.137-1.143 |
| Refractive Index | 1.527-1.533 |
55764-22-2; Ethanethioic acid, S-(2,5-dimethyl-3-furanyl) ester; S-(2,5-Dimethyl-3-furyl) ethanethioate; 2,5-Dimethyl-3-furanthiol acetate; 2,5-Dimethyl-3-thioacetoxyfuran; EINECS 259-799-1; 6FAQ96BE1Q; 1-[(2,5-dimethylfuran-3-yl)sulfanyl]ethan-1-one; DTXSID0069046; FEMA NO. 4034; 2,5-DIMETHYL-3-FURANTHIYL ACETATE; 2,5-DIMETHYL-3-FURANTHIOL ACETATE [FHFI]; THIOACETIC ACID S-(2,5-DIMETHYL-FURAN-3-YL) ESTER; 1-((2,5-dimethylfuran-3-yl)sulfanyl)ethan-1-one; RefChem:444540; DTXCID8041959
| Regulatory & Food Contact | EU Flavoring substances FDA Substance added to food: FLAVORING AGENT OR ADJUVANT Flavoring Agents FLAVOURING_AGENT: Flavouring Agent Fruit No safety concern at current levels of intake when used as a flavouring agent |
|---|---|
| GHS notification summary | 100% (89 / 89) |
| GHS notification summary | 100% (89 / 89) |
|---|
This chemical does not meet GHS hazard criteria for 100% (89 of 89) of all reports.
Reported as not meeting GHS hazard criteria by 89 of 89 companies. For more detailed information, please visit ECHA C&L website.
2,5-Dimethyl-3-thioacetoxyfuran is identified by CAS 55764-22-2, molecular formula C8H10O2S and molecular weight 170.04 g/mol. UNII 6FAQ96BE1Q; ChEBI 173776; InChIKey LULNJORVPBVGRB-UHFFFAOYSA-N. Boiling Point: 230 °C; Density: 1.137-1.143; Refractive Index: 1.527-1.533.
数据来源:PubChem / Wikidata;与随货 COA 不一致时以 COA 为准。
English page: 2,5-Dimethyl-3-thioacetoxyfuran