甲酸香茅酯（CAS 105-85-1）：分子式 C11H20O2、分子量 184.27。
| CAS号 | 105-85-1 |
|---|---|
| 分子式 | C11H20O2 |
| 分子量 | 184.27 |
| 沸点 | 235.00 °C. @ 760.00 mm Hg |
| LogP | 3.800 |
| 应用领域 | Use Classification: Fragrance Ingredients、Flavoring Agents -> JECFA Flavorings Index、Household Products: Information on 6 consumer products that contain Citronellyl Formate in the following categories is provided:、• Auto Products、• Commercial、Institutional、• Inside the Home、General Manufacturing Information: 6-Octen-1-ol、3、7-dimethyl-、1-formate: ACTIVE |
登记用途：Use Classification: Fragrance Ingredients、Flavoring Agents -> JECFA Flavorings Index、Household Products: Information on 6 consumer products that contain Citronellyl Formate in the following categories is provided:、• Auto Products、• Commercial、Institutional、• Inside the Home、General Manufacturing Information: 6-Octen-1-ol、3、7-dimethyl-、1-formate: ACTIVE。
甲酸香茅酯 是一种化工化合物，登记 CAS 号为 105-85-1，分子式 C11H20O2（分子量 184.27）。
登记 CAS 号：105-85-1
其分子式 C11H20O2 由 11 个碳、20 个氢、2 个氧 组成。
别名/同义词：甲酸香茅酯 · CITRONELLYL FORMATE · 3,7-DIMETHYL-6-OCTEN-1-YL FORMATE
甲酸香茅酯 的 CAS 登记号为 105-85-1。
分子式 C11H20O2，分子量 184.27。
别名/同义词：甲酸香茅酯、CITRONELLYL FORMATE、3,7-DIMETHYL-6-OCTEN-1-YL FORMATE。
登记用途：Use Classification: Fragrance Ingredients、Flavoring Agents -> JECFA Flavorings Index、Household Products: Information on 6 consumer products that contain Citronellyl Formate in the following categories is provided:、• Auto Products、• Commercial、Institutional、• Inside the Home、General Manufacturing Information: 6-Octen-1-ol、3、7-dimethyl-、1-formate: ACTIVE。
甲酸香茅酯（CAS 105-85-1）的独立参考数据，整理自公开化学数据库。
| CAS Registry Number | 105-85-1 |
|---|---|
| PubChem CID | 7778 |
| Molecular formula | C11H20O2 |
| IUPAC name | 3,7-dimethyloct-6-enyl formate |
| UNII (FDA) | 7B1MY2BRDK |
| FEMA number | 2314 |
| JECFA number | 53 |
| Molecular Weight | 184.27 |
|---|---|
| XLogP3 | 3.8 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 7 |
| Exact Mass | 184.146329876 |
| Monoisotopic Mass | 184.146329876 |
| Topological Polar Surface Area | 26.3 |
| Heavy Atom Count | 13 |
| Boiling Point | 235.00 °C. @ 760.00 mm Hg |
|---|---|
| Boiling Point | 235 °C |
| Density | 0.890-0.903 |
| LogP | 3.800 |
| Refractive Index | 1.443-1.452 |
Citronellyl formate; 105-85-1; 6-OCTEN-1-OL, 3,7-DIMETHYL-, FORMATE; 3,7-dimethyloct-6-enyl formate; FEMA No. 2314; (1)-3,7-Dimethyloct-6-enyl formate; DTXSID1044772; 7B1MY2BRDK; 6-Octen-1-ol, 3,7-dimethyl-, 1-formate; NSC-46117; DTXCID9024772; RefChem:577485; 203-338-9; 300-075-2; 3,7-dimethyloct-6-en-1-yl formate; Citronellol formate
| Regulatory & Food Contact | EU Flavoring substances FDA Substance added to food: FLAVORING AGENT OR ADJUVANT Flavoring Agents Fruit |
|---|---|
| GHS notification summary | 16.5% (295 / 1783) |
| GHS notification summary | 16.5% (295 / 1783) |
|---|---|
| Reported hazard statements | H315 (82.1%), H317 (81.3%) |
This chemical does not meet GHS hazard criteria for 16.5% (295 of 1783) of reports.
H315 (82.1%): Causes skin irritation [Warning Skin corrosion/irritation]
3,7-DIMETHYL-6-OCTEN-1-YL FORMATE · CAS 105-85-1 · C11H20O2. UNII 7B1MY2BRDK. Boiling Point: 235.00 °C. @ 760.00 mm Hg; Boiling Point: 235 °C; Density: 0.890-0.903.
数据来源：PubChem / Wikidata；与随货 COA 不一致时以 COA 为准。
English page: CITRONELLYL FORMATE