巴豆酸己酯（CAS 1617-25-0）：分子式 C10H18O2、分子量 170.25。
| CAS号 | 1617-25-0 |
|---|---|
| 分子式 | C10H18O2 |
| 分子量 | 170.25 |
| 沸点 | 96-98 °C (15 mm Hg) |
| LogP | 3.2 |
| 应用领域 | Use Classification: Fragrance Ingredients、Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes、Flavoring Agents -> JECFA Flavorings Index、General Manufacturing Information: 2-Butenoic acid、hexyl ester、(2E)-: INACTIVE、2-Butenoic acid、hexyl ester: ACTIVE |
登记用途：Use Classification: Fragrance Ingredients、Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes、Flavoring Agents -> JECFA Flavorings Index、General Manufacturing Information: 2-Butenoic acid、hexyl ester、(2E)-: INACTIVE、2-Butenoic acid、hexyl ester: ACTIVE。
巴豆酸己酯 是一种化工化合物，登记 CAS 号为 1617-25-0，分子式 C10H18O2（分子量 170.25）。
登记 CAS 号：1617-25-0
其分子式 C10H18O2 由 10 个碳、18 个氢、2 个氧 组成。
别名/同义词：巴豆酸己酯 · HEXYL CROTONATE
巴豆酸己酯 的 CAS 登记号为 1617-25-0。
分子式 C10H18O2，分子量 170.25。
别名/同义词：巴豆酸己酯、HEXYL CROTONATE。
登记用途：Use Classification: Fragrance Ingredients、Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes、Flavoring Agents -> JECFA Flavorings Index、General Manufacturing Information: 2-Butenoic acid、hexyl ester、(2E)-: INACTIVE、2-Butenoic acid、hexyl ester: ACTIVE。
巴豆酸己酯（CAS 1617-25-0）的独立参考数据，整理自公开化学数据库。
| CAS Registry Number | 1617-25-0 |
|---|---|
| PubChem CID | 5366038 |
| Molecular formula | C10H18O2 |
| IUPAC name | hexyl (E)-but-2-enoate |
| UNII (FDA) | L8K16M475M |
| FEMA number | 3354 |
| JECFA number | 1807 |
| Molecular Weight | 170.25 |
|---|---|
| XLogP3 | 3.2 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 7 |
| Exact Mass | 170.130679813 |
| Monoisotopic Mass | 170.130679813 |
| Topological Polar Surface Area | 26.3 |
| Heavy Atom Count | 12 |
| Boiling Point | 96-98 °C (15 mm Hg) |
|---|---|
| Density | 0.880-0.905 |
| Refractive Index | 1.428-1.442 |
Hexyl 2-butenoate; Hexyl crotonate; 19089-92-0; 2-Butenoic acid, hexyl ester; n-Hexyl 2-butenoate; 1617-25-0; CROTONIC ACID, HEXYL ESTER; Hexyl trans-2-butenoate; FEMA No. 3354; 2-Butenoic acid, hexyl ester, (2E)-; n-Hexyl 2-butenoate (natural); HEXYL-2-BUTENOATE; Crotonic acid, hexyl ester, (E)-; EINECS 242-808-8; NSC 67983; BRN 2431113
| Regulatory & Food Contact | EU Flavoring substances FDA Substance added to food: FLAVORING AGENT OR ADJUVANT Flavoring Agents FLAVOURING_AGENT: Flavouring Agent Green No safety concern at current levels of intake when used as a flavouring agent |
|---|---|
| GHS notification summary | 97.2% (1377 / 1417) |
| GHS notification summary | 97.2% (1377 / 1417) |
|---|
This chemical does not meet GHS hazard criteria for 97.2% (1377 of 1417) of all reports.
Reported as not meeting GHS hazard criteria by 1377 of 1417 companies (only 2.8% companies provided GHS information). For more detailed information, please visit ECHA C&L website.
HEXYL CROTONATE · CAS 1617-25-0 · C10H18O2. UNII L8K16M475M. Boiling Point: 96-98 °C (15 mm Hg); Density: 0.880-0.905; Refractive Index: 1.428-1.442.
数据来源：PubChem / Wikidata；与随货 COA 不一致时以 COA 为准。
English page: HEXYL CROTONATE