产品说明
一般描述
Specific rotations of chiral conformers of 1-fluoroheptane were computed using an approach in which localization is enforced throughout the orbital optimization and subsequent linear response computation.
包装
1 g in glass bottle
基本信息
| 线性分子式 | CH3(CH2)6F |
| 分子量 | 118.19 |
| EC 号 | 211-545-0 |
| MDL编号 | MFCD00013581 |
| PubChem化学物质编号 | 24855033 |
| NACRES | NA.22 |
产品性质
| 质量水平 | 100 |
| 测定 | 98% |
| 形式 | liquid |
| 折射率 | n |
| bp | 119.2 ℃/750 mmHg (lit.) |
| 密度 | 0.806 g/mL at 25 ℃ (lit.) |
| SMILES string | CCCCCCCF |
| InChI | 1S/C7H15F/c1-2-3-4-5-6-7-8/h2-7H2,1H3 |
| InChI key | BITLXSQYFZTQGC-UHFFFAOYSA-N |
安全信息
| 象形图 |   |
| 警示用语： | Danger |
| 危险声明 | H225 - H315 - H319 - H335 |
| 预防措施声明 | P210 - P302 + P352 - P305 + P351 + P338 |
| 危险分类 | Eye Irrit. 2 - Flam. Liq. 2 - Skin Irrit. 2 - STOT SE 3 |
| 靶器官 | Respiratory system |
| 储存分类代码 | 3 - Flammable liquids |
| WGK | WGK 3 |
| 闪点(F) | 57.2 °F - closed cup |
| 闪点(C) | 14 ℃ - closed cup |
| 个人防护装备 | Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter |
Sigma-Aldrich
m.cnreagent.com
