基本信息
| 线性分子式 | CH3CH2CH(CH3)COOCH2CH2CH2CH3 |
| 分子量 | 158.24 |
| FEMA编号 | 3393 |
| Beilstein | 1702551 |
| EC 号 | 239-798-2 |
| 欧洲委员会编号 | 10534 |
| MDL编号 | MFCD00042902 |
| PubChem化学物质编号 | 24901686 |
| Flavis编号 | 9.519 |
| NACRES | NA.21 |
产品性质
| 质量水平 | 400 |
| 生物来源 | synthetic |
| 等级 | FG Halal Kosher |
| agency | follows IFRA guidelines |
| reg. compliance | EU Regulation 1223/2009 EU Regulation 1334/2008 & 178/2002 |
| 测定 | ≥97% |
| 折射率 | n |
| bp | 173-176 ℃/730 mmHg (lit.) |
| 密度 | 0.863 g/mL at 25 ℃ (lit.) |
| 文件 | see Safety & Documentation for available documents |
| 性状检查 | fruity; tropical; sweet |
| application(s) | flavors and fragrances |
| 食品过敏原 | no known allergens |
| 致敏芳香化合物 | no known allergens |
| SMILES string | CCCCOC(=O)C(C)CC |
| InChI | 1S/C9H18O2/c1-4-6-7-11-9(10)8(3)5-2/h8H,4-7H2,1-3H3 |
| InChI key | OTKQNSSMCDLVQV-UHFFFAOYSA-N |
安全信息
| 象形图 |   |
| 警示用语： | Warning |
| 危险声明 | H226 - H411 |
| 预防措施声明 | P210 - P233 - P240 - P241 - P242 - P273 |
| 危险分类 | Aquatic Chronic 2 - Flam. Liq. 3 |
| 储存分类代码 | 3 - Flammable liquids |
| WGK | WGK 3 |
| 闪点(F) | 140.0 °F - closed cup |
| 闪点(C) | 60 ℃ - closed cup |
| 个人防护装备 | Eyeshields, Gloves, multi-purpose combination respirator cartridge (US) |
Sigma-Aldrich
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