4-烯丙基-2-甲氧基苯基苯甲酸酯（CAS 531-26-0）：分子式 C17H16O3、分子量 268.31。
| CAS号 | 531-26-0 |
|---|---|
| 分子式 | C17H16O3 |
| 分子量 | 268.31 |
| 熔点 | 69 - 70 °C |
| 沸点 | 360.00 °C. @ 760.00 mm Hg |
| LogP | 4.4 |
| 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: Phenol、2-methoxy-4-(2-propen-1-yl)-、1-benzoate: INACTIVE |
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: Phenol、2-methoxy-4-(2-propen-1-yl)-、1-benzoate: INACTIVE。
4-烯丙基-2-甲氧基苯基苯甲酸酯 是一种化工化合物，登记 CAS 号为 531-26-0，分子式 C17H16O3（分子量 268.31）。
登记 CAS 号：531-26-0
其分子式 C17H16O3 由 17 个碳、16 个氢、3 个氧 组成。
别名/同义词：4-烯丙基-2-甲氧基苯基苯甲酸酯 · 4-allyl-2-methoxyphenyl benzoate
4-烯丙基-2-甲氧基苯基苯甲酸酯 的 CAS 登记号为 531-26-0。
分子式 C17H16O3，分子量 268.31。
别名/同义词：4-烯丙基-2-甲氧基苯基苯甲酸酯、4-allyl-2-methoxyphenyl benzoate。
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: Phenol、2-methoxy-4-(2-propen-1-yl)-、1-benzoate: INACTIVE。
4-烯丙基-2-甲氧基苯基苯甲酸酯（CAS 531-26-0）的独立参考数据，整理自公开化学数据库。
| CAS Registry Number | 531-26-0 |
|---|---|
| PubChem CID | 62362 |
| Molecular formula | C17H16O3 |
| IUPAC name | (2-methoxy-4-prop-2-enylphenyl) benzoate |
| UNII (FDA) | YRO21E9Z35 |
| FEMA number | 2471 |
| JECFA number | 1533 |
| Molecular Weight | 268.31 |
|---|---|
| XLogP3 | 4.4 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 6 |
| Exact Mass | 268.109944368 |
| Monoisotopic Mass | 268.109944368 |
| Topological Polar Surface Area | 35.5 |
| Heavy Atom Count | 20 |
| Boiling Point | 360.00 °C. @ 760.00 mm Hg |
|---|---|
| Melting Point | 69 - 70 °C |
Eugenyl benzoate; Eugenol benzoate; 4-Allyl-2-methoxyphenyl benzoate; 531-26-0; Benzoyl eugenol; p-Eugenol, benzoate; FEMA No. 2471; PHENOL, 2-METHOXY-4-(2-PROPENYL)-, BENZOATE; Phenol, 4-allyl-2-methoxy-, benzoate; Phenol, 2-methoxy-4-(2-propen-1-yl)-, 1-benzoate; YRO21E9Z35; 2-Methoxy-4-(2-propenyl)phenyl benzoate; EINECS 208-504-4; NSC 408913; NSC-408913; AI3-23236
| Regulatory & Food Contact | EU Flavoring substances FDA Substance added to food: FLAVORING AGENT OR ADJUVANT Flavoring Agents FLAVOURING_AGENT: Flavouring Agent No safety concern at current levels of intake when used as a flavouring agent TRS 934-JECFA 65/49 |
|---|
| Reported hazard statements | H317 (100%) |
|---|
H317 (100%): May cause an allergic skin reaction [Warning Sensitization, Skin]
P261, P272, P280, P302+P352, P321, P333+P317, P362+P364, and P501 (click each P-code to see the statement)
4-allyl-2-methoxyphenyl benzoate · CAS 531-26-0 · C17H16O3. UNII YRO21E9Z35. Boiling Point: 360.00 °C. @ 760.00 mm Hg; Melting Point: 69 - 70 °C.
数据来源：PubChem / Wikidata；与随货 COA 不一致时以 COA 为准。
English page: 4-allyl-2-methoxyphenyl benzoate