丁酸肉桂酯(CAS 103-61-7):分子式 C13H16O2、分子量 204.26。
| CAS号 | 103-61-7 |
|---|---|
| 分子式 | C13H16O2 |
| 分子量 | 204.26 |
| 沸点 | 300 °C |
| LogP | 3.1 |
| 应用领域 | 香精香料 |
登记用途:香精香料。
丁酸肉桂酯 是一种化工化合物,登记 CAS 号为 103-61-7,分子式 C13H16O2(分子量 204.26)。
登记 CAS 号:103-61-7
其分子式 C13H16O2 由 13 个碳、16 个氢、2 个氧 组成。
别名/同义词:丁酸肉桂酯 · Cinnamyl butyrate
丁酸肉桂酯 的 CAS 登记号为 103-61-7。
分子式 C13H16O2,分子量 204.26。
别名/同义词:丁酸肉桂酯、Cinnamyl butyrate。
登记用途:香精香料。
丁酸肉桂酯(CAS 103-61-7)的独立参考数据,整理自公开化学数据库。
| CAS Registry Number | 103-61-7 |
|---|---|
| PubChem CID | 5355254 |
| Molecular formula | C13H16O2 |
| Molecular weight | 204.12 g/mol |
| IUPAC name | [(E)-3-phenylprop-2-enyl] butanoate |
| InChIKey | YZYPQKZWNXANRB-UXBLZVDNSA-N |
| UNII (FDA) | TKZ9V37P1G |
| ChEBI ID | CHEBI:195938 |
| FEMA number | 2296 |
| JECFA number | 652 |
| Molecular Weight | 204.26 |
|---|---|
| XLogP3 | 3.1 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 6 |
| Exact Mass | 204.115029749 |
| Monoisotopic Mass | 204.115029749 |
| Topological Polar Surface Area | 26.3 |
| Heavy Atom Count | 15 |
| Boiling Point | 300 °C |
|---|---|
| Density | 1.010-1.020 |
| Refractive Index | 1.525-1.530 |
Cinnamyl butyrate; 103-61-7; Cinnamyl butanoate; 78761-39-4; BUTYRIC ACID, CINNAMYL ESTER; FEMA No. 2296; 3-Phenyl-2-propen-1-yl butanoate; Butanoic acid, 3-phenyl-2-propenyl ester; [(E)-3-phenylprop-2-enyl] butanoate; TKZ9V37P1G; NSC-30528; Butanoic acid, 3-phenyl-2-propen-1-yl ester; ((E)-3-phenylprop-2-enyl) butanoate; DTXSID2059277; 3-phenylprop-2-enyl butanoate; RefChem:577222
| 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 | 86.2% (238 / 276) |
| GHS notification summary | 86.2% (238 / 276) |
|---|---|
| Reported hazard statements | H302 (13.8%), H312 (13.8%), H315 (13.8%), H319 (13.8%), H332 (13.8%), H335 (13.8%) |
This chemical does not meet GHS hazard criteria for 86.2% (238 of 276) of all reports.
H302 (13.8%): Harmful if swallowed [Warning Acute toxicity, oral]
Cinnamyl butyrate is identified by CAS 103-61-7, molecular formula C13H16O2 and molecular weight 204.12 g/mol. UNII TKZ9V37P1G; ChEBI 195938; InChIKey YZYPQKZWNXANRB-UXBLZVDNSA-N. Boiling Point: 300 °C; Density: 1.010-1.020; Refractive Index: 1.525-1.530.
数据来源:PubChem / Wikidata;与随货 COA 不一致时以 COA 为准。
English page: Cinnamyl butyrate