2-甲基丁酸-2-苯乙酯（CAS 24817-51-4）：分子式 C13H18O2、分子量 206.28。
| CAS号 | 24817-51-4 |
|---|---|
| 分子式 | C13H18O2 |
| 分子量 | 206.28 |
| 沸点 | 136.00 °C. @ 30.00 mm Hg |
| LogP | 3.5 |
2-甲基丁酸-2-苯乙酯 是一种化工化合物，登记 CAS 号为 24817-51-4，分子式 C13H18O2（分子量 206.28）。
登记 CAS 号：24817-51-4
其分子式 C13H18O2 由 13 个碳、18 个氢、2 个氧 组成。
别名/同义词：2-甲基丁酸-2-苯乙酯 · 2-phenylethyl 2-methylbutyrate · Phenethyl 2-methylbutyrate
2-甲基丁酸-2-苯乙酯 的 CAS 登记号为 24817-51-4。
分子式 C13H18O2，分子量 206.28。
别名/同义词：2-甲基丁酸-2-苯乙酯、2-phenylethyl 2-methylbutyrate、Phenethyl 2-methylbutyrate。
2-甲基丁酸-2-苯乙酯（CAS 24817-51-4）的独立参考数据，整理自公开化学数据库。
| CAS Registry Number | 24817-51-4 |
|---|---|
| PubChem CID | 520148 |
| Molecular formula | C13H18O2 |
| Molecular weight | 206.13 g/mol |
| IUPAC name | 2-phenylethyl 2-methylbutanoate |
| InChIKey | KVKKTLBBYFABAZ-UHFFFAOYSA-N |
| UNII (FDA) | 4D2I5SJ45Q |
| FEMA number | 3632 |
| JECFA number | 993 |
| Molecular Weight | 206.28 |
|---|---|
| XLogP3 | 3.5 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 6 |
| Exact Mass | 206.130679813 |
| Monoisotopic Mass | 206.130679813 |
| Topological Polar Surface Area | 26.3 |
| Heavy Atom Count | 15 |
| Boiling Point | 136.00 °C. @ 30.00 mm Hg |
|---|---|
| Boiling Point | 230 °C |
| Density | 0.974-0.980 |
| Refractive Index | 1.481-1.489 |
24817-51-4; Phenethyl 2-methylbutyrate; 2-Phenylethyl 2-methylbutanoate; Butanoic acid, 2-methyl-, 2-phenylethyl ester; Phenylethyl 2-methylbutyrate; Butyric acid, 2-methyl-, phenethyl ester; FEMA No. 3632; DTXSID2047567; 4D2I5SJ45Q; DTXCID0027567; RefChem:860578; 246-476-5; phenethyl 2-methylbutanoate; 2-Phenylethyl 2-methylbutyrate; Phenylethyl 2-methylbutanoate; Benzylcarbinyl 2-methylbutyrate
| Regulatory & Food Contact | 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 notification summary | 100% (262 / 262) |
| GHS notification summary | 100% (262 / 262) |
|---|
This chemical does not meet GHS hazard criteria for 100% (262 of 262) of all reports.
Reported as not meeting GHS hazard criteria by 262 of 262 companies. For more detailed information, please visit ECHA C&L website.
Phenethyl 2-methylbutyrate is identified by CAS 24817-51-4, molecular formula C13H18O2 and molecular weight 206.13 g/mol. UNII 4D2I5SJ45Q; InChIKey KVKKTLBBYFABAZ-UHFFFAOYSA-N. Boiling Point: 136.00 °C. @ 30.00 mm Hg; Boiling Point: 230 °C; Density: 0.974-0.980.
数据来源：PubChem / Wikidata；与随货 COA 不一致时以 COA 为准。
English page: 2-phenylethyl 2-methylbutyrate