乙酸桃金娘烯酯（CAS 1079-01-2）：分子式 C12H18O2、分子量 194.27。
| CAS号 | 1079-01-2 |
|---|---|
| 分子式 | C12H18O2 |
| 分子量 | 194.27 |
| 沸点 | 134 °C (38 mm Hg) |
| LogP | 2.2 |
| 应用领域 | Use Classification: Fragrance Ingredients、Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes、Flavoring Agents -> JECFA Flavorings Index、General Manufacturing Information: Bicyclo[3.1.1]hept-2-ene-2-methanol、6、6-dimethyl-、2-acetate、(1S、5R)-: ACTIVE |
登记用途：Use Classification: Fragrance Ingredients、Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes、Flavoring Agents -> JECFA Flavorings Index、General Manufacturing Information: Bicyclo[3.1.1]hept-2-ene-2-methanol、6、6-dimethyl-、2-acetate、(1S、5R)-: ACTIVE。
乙酸桃金娘烯酯 是一种化工化合物，登记 CAS 号为 1079-01-2，分子式 C12H18O2（分子量 194.27）。
登记 CAS 号：1079-01-2
其分子式 C12H18O2 由 12 个碳、18 个氢、2 个氧 组成。
别名/同义词：乙酸桃金娘烯酯 · FEMA 3765
乙酸桃金娘烯酯 的 CAS 登记号为 1079-01-2。
分子式 C12H18O2，分子量 194.27。
别名/同义词：乙酸桃金娘烯酯、FEMA 3765。
登记用途：Use Classification: Fragrance Ingredients、Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes、Flavoring Agents -> JECFA Flavorings Index、General Manufacturing Information: Bicyclo[3.1.1]hept-2-ene-2-methanol、6、6-dimethyl-、2-acetate、(1S、5R)-: ACTIVE。
乙酸桃金娘烯酯（CAS 1079-01-2）的独立参考数据，整理自公开化学数据库。
| CAS 号 | 1079-01-2 |
|---|---|
| PubChem CID | 11435490 |
| 分子式 | C12H18O2 |
| IUPAC 名称 | [(1S,5R)-6,6-dimethyl-2-bicyclo[3.1.1]hept-2-enyl]methyl acetate |
| UNII（FDA） | TI50YAB469 |
| FEMA 编号 | 3765 |
| JECFA 编号 | 982 |
| Molecular Weight | 194.27 |
|---|---|
| XLogP3 | 2.2 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 3 |
| Exact Mass | 194.130679813 |
| Monoisotopic Mass | 194.130679813 |
| Topological Polar Surface Area | 26.3 |
| Heavy Atom Count | 14 |
| Boiling Point | 134 °C (38 mm Hg) |
|---|---|
| Density | 0.987-0.996 |
| Refractive Index | 1.470-1.477 |
Myrtenyl acetate; 1079-01-2; (+)-Myrtenyl acetate; 2-Pinen-10-ol, acetate; FEMA No. 3765; TI50YAB469; Bicyclo[3.1.1]hept-2-ene-2-methanol, 6,6-dimethyl-, 2-acetate, (1S,5R)-; 2-Pinen-10-yl acetate; [(1S,5R)-6,6-dimethyl-2-bicyclo[3.1.1]hept-2-enyl]methyl acetate; UNII-TI50YAB469; MYRTENYL ACETATE [FHFI]; DTXSID70889329; EINECS 214-088-5; Bicyclo(3.1.1)hept-2-ene-2-methanol, 6,6-dimethyl-, 2-acetate, (1S,5R)-; BICYCLO(3.1.1)HEPT-2-ENE-2-METHANOL, 6,6-DIMETHYL-, ACETATE, (1S)-; (1S)-6,6-Dimethylbicyclo(3.1.1)hept-2-ene-2-methanol acetate
| 法规与食品接触 | EU Flavoring substances FDA Substance added to food: FLAVORING AGENT OR ADJUVANT Flavoring Agents FLAVOURING_AGENT: Flavouring Agent Floral No safety concern at current levels of intake when used as a flavouring agent |
|---|---|
| GHS 通报统计 | 100% (116 / 116) |
| GHS 通报统计 | 100% (116 / 116) |
|---|
乙酸桃金娘烯酯 · CAS 1079-01-2 · C12H18O2. UNII TI50YAB469. Boiling Point: 134 °C (38 mm Hg); Density: 0.987-0.996; Refractive Index: 1.470-1.477.
数据来源：PubChem / Wikidata；与随货 COA 不一致时以 COA 为准。
English page: FEMA 3765