英文别名 | Methyl (4S)-4-(2-chloro-4-fluorophenyl)-6-methyl-2-(1,3-thiazol-2-yl)-1,4-dihydro-5-pyrimidinecarboxylate |
CAS号 | 1236208-59-5 |
SMILES | O=C(C1=C(C)NC(C2=NC=CS2)=N[C@@H]1C3=CC=C(F)C=C3Cl)OC
CC1NC(=N[C@@H](C=1C(=O)OC)C1=CC=C(F)C=C1Cl)C1=NC=CS1 |
Inchi | InChI=1S/C16H13ClFN3O2S/c1-8-12(16(22)23-2)13(10-4-3-9(18)7-11(10)17)21-14(20-8)15-19-5-6-24-15/h3-7,13H,1-2H3,(H,20,21)/t13-/m1/s1 |
InchiKey | QMZPEPRAOFNSQH-CYBMUJFWSA-N |
分子式 Formula | C16H13ClFN3O2S |
分子量 Molecular Weight | 365.81 |
闪点 FP | 236.2±31.5 ℃ |
沸点 Boiling point | 466.9±55.0 ℃ at 760 mmHg |
Polarizability极化度 | 36.5±0.5 10-24cm3 |
密度 Density | 1.5±0.1 g/cm3 |
蒸汽压 Vapor Pressure | 0.0±1.2 mmHg at 25℃ |
储藏条件 Storage conditions | storage at -4℃ (1-2weeks), longer storage period at -20℃ (1-2years) |