甲酸茴香酯（CAS 122-91-8）：分子式 C9H10O3、分子量 166.17。
| CAS号 | 122-91-8 |
|---|---|
| 分子式 | C9H10O3 |
| 分子量 | 166.17 |
| 沸点 | 220.00 °C. @ 760.00 mm Hg |
| LogP | 1.7 |
甲酸茴香酯 是一种化工化合物，登记 CAS 号为 122-91-8，分子式 C9H10O3（分子量 166.17）。
登记 CAS 号：122-91-8
其分子式 C9H10O3 由 9 个碳、10 个氢、3 个氧 组成。
别名/同义词：甲酸茴香酯 · anisyl formate
甲酸茴香酯 的 CAS 登记号为 122-91-8。
分子式 C9H10O3，分子量 166.17。
别名/同义词：甲酸茴香酯、anisyl formate。
甲酸茴香酯（CAS 122-91-8）的独立参考数据，整理自公开化学数据库。
| CAS Registry Number | 122-91-8 |
|---|---|
| PubChem CID | 61054 |
| Molecular formula | C9H10O3 |
| Molecular weight | 166.06 g/mol |
| IUPAC name | (4-methoxyphenyl)methyl formate |
| InChIKey | XPDORSROGAZEGY-UHFFFAOYSA-N |
| UNII (FDA) | 7N0ADO5BXI |
| ChEBI ID | CHEBI:173752 |
| FEMA number | 2101 |
| JECFA number | 872 |
| Molecular Weight | 166.17 |
|---|---|
| XLogP3 | 1.7 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 4 |
| Exact Mass | 166.062994177 |
| Monoisotopic Mass | 166.062994177 |
| Topological Polar Surface Area | 35.5 |
| Heavy Atom Count | 12 |
| Boiling Point | 220.00 °C. @ 760.00 mm Hg |
|---|---|
| Boiling Point | 220 °C |
| Density | 1.136-1.145 |
| Refractive Index | 1.519-1.525 |
4-Methoxybenzyl formate; Anisyl formate; 122-91-8; (4-methoxyphenyl)methyl formate; Anisyl alcohol, formate; BENZENEMETHANOL, 4-METHOXY-, FORMATE; Benzyl alcohol, p-methoxy-, formate; FEMA No. 2101; DTXSID7047649; 7N0ADO5BXI; NSC-5949; DTXCID5027649; RefChem:112844; 204-582-9; p-Methoxybenzyl formate; Anisyl methanoate
| 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 | H302 (100%) |
|---|
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P270, P301+P317, P330, and P501 (click each P-code to see the statement)
anisyl formate is identified by CAS 122-91-8, molecular formula C9H10O3 and molecular weight 166.06 g/mol. UNII 7N0ADO5BXI; ChEBI 173752; InChIKey XPDORSROGAZEGY-UHFFFAOYSA-N. Boiling Point: 220.00 °C. @ 760.00 mm Hg; Boiling Point: 220 °C; Density: 1.136-1.145.
数据来源：PubChem / Wikidata；与随货 COA 不一致时以 COA 为准。
English page: anisyl formate