胡椒基异丁酸酯(CAS 5461-08-5):分子式 C12H14O4、分子量 222.24。
| CAS号 | 5461-08-5 |
|---|---|
| 分子式 | C12H14O4 |
| 分子量 | 222.24 |
| LogP | 2.7 |
胡椒基异丁酸酯 是一种化工化合物,登记 CAS 号为 5461-08-5,分子式 C12H14O4(分子量 222.24)。
登记 CAS 号:5461-08-5
其分子式 C12H14O4 由 12 个碳、14 个氢、4 个氧 组成。
别名/同义词:胡椒基异丁酸酯 · piperonyl isobutyrate
胡椒基异丁酸酯 的 CAS 登记号为 5461-08-5。
分子式 C12H14O4,分子量 222.24。
别名/同义词:胡椒基异丁酸酯、piperonyl isobutyrate。
胡椒基异丁酸酯(CAS 5461-08-5)的独立参考数据,整理自公开化学数据库。
| CAS Registry Number | 5461-08-5 |
|---|---|
| PubChem CID | 62580 |
| Molecular formula | C12H14O4 |
| IUPAC name | 1,3-benzodioxol-5-ylmethyl 2-methylpropanoate |
| UNII (FDA) | Y8HBR1ACYA |
| FEMA number | 2913 |
| Molecular Weight | 222.24 |
|---|---|
| XLogP3 | 2.7 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 4 |
| Exact Mass | 222.08920892 |
| Monoisotopic Mass | 222.08920892 |
| Topological Polar Surface Area | 44.8 |
| Heavy Atom Count | 16 |
Piperonyl isobutyrate; 5461-08-5; Piperonyl 2-methylpropanoate; Heliotropyl 2-methylpropanoate; Y8HBR1ACYA; FEMA No. 2913; NSC-23947; PROPANOIC ACID, 2-METHYL-, 1,3-BENZODIOXOL-5-YLMETHYL ESTER; DTXSID8063917; 2H-1,3-benzodioxol-5-ylmethyl 2-methylpropanoate; RefChem:174463; DTXCID1041762; 1,3-benzodioxole-5-methanol isobutyrate; 226-745-3; 229-993-0; 1,3-Benzodioxol-5-ylmethyl 2-methylpropanoate
| 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 |
|---|---|
| GHS notification summary | 0.8% (11 / 1399) |
| GHS notification summary | 0.8% (11 / 1399) |
|---|---|
| Reported hazard statements | H302 (99.2%) |
This chemical does not meet GHS hazard criteria for 0.8% (11 of 1399) of reports.
H302 (99.2%): Harmful if swallowed [Warning Acute toxicity, oral]
piperonyl isobutyrate · CAS 5461-08-5 · C12H14O4. UNII Y8HBR1ACYA.
数据来源:PubChem / Wikidata;与随货 COA 不一致时以 COA 为准。
English page: piperonyl isobutyrate