辛酸乙酯（CAS 106-32-1）：分子式 C10H20O2、分子量 172.26。
| CAS号 | 106-32-1 |
|---|---|
| 分子式 | C10H20O2 |
| 分子量 | 172.26 |
| 熔点 | -43.1 °C |
| 沸点 | 206.00 to 208.00 °C. @ 760.00 mm Hg |
| LogP | 3.5 |
| 应用领域 | Use Classification: Fragrance Ingredients、Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes、Flavoring Agents -> JECFA Flavorings Index、Household Products: Information on 4 consumer products that contain Ethyl Octanoate in the following categories is provided:、• Auto Products、• Inside the Home、General Manufacturing Information: Octanoic acid、ethyl ester: ACTIVE |
登记用途：Use Classification: Fragrance Ingredients、Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes、Flavoring Agents -> JECFA Flavorings Index、Household Products: Information on 4 consumer products that contain Ethyl Octanoate in the following categories is provided:、• Auto Products、• Inside the Home、General Manufacturing Information: Octanoic acid、ethyl ester: ACTIVE。
辛酸乙酯 是一种化工化合物，登记 CAS 号为 106-32-1，分子式 C10H20O2（分子量 172.26）。
登记 CAS 号：106-32-1
其分子式 C10H20O2 由 10 个碳、20 个氢、2 个氧 组成。
别名/同义词：辛酸乙酯 · Ethyl caprylate
辛酸乙酯 的 CAS 登记号为 106-32-1。
分子式 C10H20O2，分子量 172.26。
别名/同义词：辛酸乙酯、Ethyl caprylate。
登记用途：Use Classification: Fragrance Ingredients、Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes、Flavoring Agents -> JECFA Flavorings Index、Household Products: Information on 4 consumer products that contain Ethyl Octanoate in the following categories is provided:、• Auto Products、• Inside the Home、General Manufacturing Information: Octanoic acid、ethyl ester: ACTIVE。
辛酸乙酯（CAS 106-32-1）的独立参考数据，整理自公开化学数据库。
| CAS Registry Number | 106-32-1 |
|---|---|
| PubChem CID | 7799 |
| Molecular formula | C10H20O2 |
| Molecular weight | 172.15 g/mol |
| IUPAC name | ethyl octanoate |
| InChIKey | YYZUSRORWSJGET-UHFFFAOYSA-N |
| UNII (FDA) | 81C5MOP582 |
| ChEBI ID | CHEBI:87426 |
| FEMA number | 2449 |
| JECFA number | 33 |
| Molecular Weight | 172.26 |
|---|---|
| XLogP3 | 3.5 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 8 |
| Exact Mass | 172.146329876 |
| Monoisotopic Mass | 172.146329876 |
| Topological Polar Surface Area | 26.3 |
| Heavy Atom Count | 12 |
| Boiling Point | 206.00 to 208.00 °C. @ 760.00 mm Hg |
|---|---|
| Boiling Point | 209 °C |
| Melting Point | -43.1 °C |
| Solubility | 0.0701 mg/mL at 25 °C |
| Density | 0.865-0.868 |
| Refractive Index | 1.417-1.419 |
ETHYL OCTANOATE; Ethyl caprylate; 106-32-1; Ethyl n-octanoate; Octanoic acid, ethyl ester; Caprylic acid ethyl ester; Ethyl octoate; FEMA No. 2449; DTXSID8051542; 81C5MOP582; NSC-8898; DTXCID9030094; CHEBI:87426; RefChem:139025; 203-385-5; octanoic acid ethyl ester
| Regulatory & Food Contact | EU Flavoring substances FDA Substance added to food: FLAVORING AGENT OR ADJUVANT Flavoring Agents FLAVOURING_AGENT: Flavouring Agent Apricot, Brandy, Fat, Floral, Pineapple No safety concern at current levels of intake when used as a flavouring agent |
|---|---|
| GHS notification summary | 91.9% (1639 / 1784) |
| GHS notification summary | 91.9% (1639 / 1784) |
|---|
This chemical does not meet GHS hazard criteria for 91.9% (1639 of 1784) of all reports.
Reported as not meeting GHS hazard criteria by 1639 of 1784 companies (only 8.1% companies provided GHS information). For more detailed information, please visit ECHA C&L website.
Ethyl caprylate is identified by CAS 106-32-1, molecular formula C10H20O2 and molecular weight 172.15 g/mol. UNII 81C5MOP582; ChEBI 87426; InChIKey YYZUSRORWSJGET-UHFFFAOYSA-N. Boiling Point: 206.00 to 208.00 °C. @ 760.00 mm Hg; Boiling Point: 209 °C; Melting Point: -43.1 °C.
数据来源：PubChem / Wikidata；与随货 COA 不一致时以 COA 为准。
English page: Ethyl caprylate