| 英文别名 | Phenylthiohydantoin-isoleucine (contains PTH-alloisoleucine): |
| CAS号 | 5066-94-4 |
| SMILES | CCC(C)C1C(=O)N(C(=S)N1)c2ccccc2 |
| Inchi | InChI=1S/C13H16N2OS/c1-3-9(2)11-12(16)15(13(17)14-11)10-7-5-4-6-8-10/h4-9,11H,3H2,1-2H3,(H,14,17) |
| InchiKey | NMRFWXLNHGJLIU-UHFFFAOYSA-N |
| 分子式 Formula | C13H16N2OS |
| 分子量 Molecular Weight | 248 |
| 闪点 FP | 158.1±23.2 ℃ |
| 熔点 Melting point | 182 ℃TCI182 ℃TCIP0365 |
| 沸点 Boiling point | 337.8±25.0 ℃ at 760 mmHg |
| Polarizability极化度 | 28.5±0.5 10-24cm3 |
| 密度 Density | 1.2±0.1 g/cm3 |
| 蒸汽压 Vapor Pressure | 0.0±0.7 mmHg at 25℃ |
| 储藏条件 Storage conditions | storage at -4℃ (1-2weeks), longer storage period at -20℃ (1-2years) |
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