4-苯基丁酸乙酯（CAS 10031-93-3）：分子式 C12H16O2、分子量 192.25。
| CAS号 | 10031-93-3 |
|---|---|
| 分子式 | C12H16O2 |
| 分子量 | 192.25 |
| 沸点 | 275.00 to 276.00 °C. @ 760.00 mm Hg |
| LogP | 3.1 |
4-苯基丁酸乙酯 是一种化工化合物，登记 CAS 号为 10031-93-3，分子式 C12H16O2（分子量 192.25）。
登记 CAS 号：10031-93-3
其分子式 C12H16O2 由 12 个碳、16 个氢、2 个氧 组成。
别名/同义词：4-苯基丁酸乙酯 · ETHYL 4-PHENYLBUTYRATE
4-苯基丁酸乙酯 的 CAS 登记号为 10031-93-3。
分子式 C12H16O2，分子量 192.25。
别名/同义词：4-苯基丁酸乙酯、ETHYL 4-PHENYLBUTYRATE。
4-苯基丁酸乙酯（CAS 10031-93-3）的独立参考数据，整理自公开化学数据库。
| CAS Registry Number | 10031-93-3 |
|---|---|
| PubChem CID | 61452 |
| Molecular formula | C12H16O2 |
| Molecular weight | 192.12 g/mol |
| IUPAC name | ethyl 4-phenylbutanoate |
| InChIKey | GGFNXKFGVQQNRV-UHFFFAOYSA-N |
| UNII (FDA) | BU9R7P5U55 |
| ChEBI ID | CHEBI:179907 |
| FEMA number | 2453 |
| JECFA number | 1458 |
| Molecular Weight | 192.25 |
|---|---|
| XLogP3 | 3.1 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 6 |
| Exact Mass | 192.115029749 |
| Monoisotopic Mass | 192.115029749 |
| Topological Polar Surface Area | 26.3 |
| Heavy Atom Count | 14 |
| Boiling Point | 275.00 to 276.00 °C. @ 760.00 mm Hg |
|---|---|
| Boiling Point | 141-144 °C (12 mm Hg) |
| Density | 0.986-0.992 |
| Refractive Index | 1.489-1.495 |
Ethyl 4-phenylbutanoate; 10031-93-3; Ethyl 4-phenylbutyrate; Benzenebutanoic acid, ethyl ester; Ethyl 4-phenyl butyrate; Ethyl benzenebutanoate; Ethyl gamma-phenylbutyrate; UNII-BU9R7P5U55; FEMA No. 2453; NSC-163318; BU9R7P5U55; NSC 163318; Ethyl .gamma.-phenylbutyrate; AI3-34131; DTXSID90143132; ETHYL 4-PHENYLBUTYRATE [FHFI]
| Regulatory & Food Contact | EU Flavoring substances FDA Substance added to food: FLAVOR ENHANCER, 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 |
|---|
| Reported hazard statements | H315 (100%), H319 (100%), H335 (100%) |
|---|
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
ETHYL 4-PHENYLBUTYRATE is identified by CAS 10031-93-3, molecular formula C12H16O2 and molecular weight 192.12 g/mol. UNII BU9R7P5U55; ChEBI 179907; InChIKey GGFNXKFGVQQNRV-UHFFFAOYSA-N. Boiling Point: 275.00 to 276.00 °C. @ 760.00 mm Hg; Boiling Point: 141-144 °C (12 mm Hg); Density: 0.986-0.992.
数据来源：PubChem / Wikidata；与随货 COA 不一致时以 COA 为准。
English page: ETHYL 4-PHENYLBUTYRATE