| 英文别名 | Ethyl 6-({4,4-bis[(~2~H_3_)methyl]-3,4-dihydro-2H-thiochromen-6-yl}ethynyl)nicotinate: |
| CAS号 | 1246815-76-8 |
| SMILES | [2H]C([2H])([2H])C1(CCSc2c1cc(cc2)C#Cc3ccc(cn3)C(=O)OCC)C([2H])([2H])[2H] |
| Inchi | InChI=1S/C21H21NO2S/c1-4-24-20(23)16-7-9-17(22-14-16)8-5-15-6-10-19-18(13-15)21(2,3)11-12-25-19/h6-7,9-10,13-14H,4,11-12H2,1-3H3/i2D3,3D3 |
| InchiKey | OGQICQVSFDPSEI-XERRXZQWSA-N |
| 分子式 Formula | C21H13D8NO2S |
| 分子量 Molecular Weight | 360 |
| 闪点 FP | 256.1±28.7 ℃ |
| 沸点 Boiling point | 499.8±45.0 ℃ at 760 mmHg |
| Polarizability极化度 | 40.2±0.5 10-24cm3 |
| 密度 Density | 1.2±0.1 g/cm3 |
| 蒸汽压 Vapor Pressure | 0.0±1.3 mmHg at 25℃ |
| 储藏条件 Storage conditions | storage at -4℃ (1-2weeks), longer storage period at -20℃ (1-2years) |
