
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 1187586-58-8 |
| Catalog No. | 2A-3179433 |
| Chinese Name | 1-[[[(1R)-1-[3-[(1S)-1-[[[1-(羧甲基)环丙基]甲基]硫基]-2-(7-氯-2-喹啉基)乙基]苯基]-3-[2-(1-羟基-1-甲基乙基)苯基]丙基]硫基]甲基]环丙烷乙酸 |
| Synonyms | Exact Mass 731.25100; PSA 158.32000; LogP 10.04950; InChIKey SJNODSMYYCYZTO-XDSPJLLDSA-N; Storage condition 2-8℃; Synonyms |
| Molecular Formula | C41H46ClNO5S2 |
| Molecular Weight | 267.36 |
| Density | 1.302±0.06 g/cm3 |
| Boiling Point | 856.9±65.0℃(Predicted) |
| Water Solubility | Insuluble (1.5E-5 g/L) (25 ºC) |
| Storage Condition | 2-8℃ |
| PubChem ID | 85241218 |
| MDL Number | MFCD18379554 |
| SMILES | CC(C)(O)c1ccccc1CCC(SCC1(CC(=O)O)CC1)c1cccc(C(Cc2ccc3ccc(Cl)cc3n2)SCC2(CC(=O)O)CC2)c1 |
| InChI | InChI=1S/C41H46ClNO5S2/c1-39(2,48)33-9-4-3-6-27(33)12-15-35(49-25-40(16-17-40)23-37(44)45)29-7-5-8-30(20-29)36(50-26-41(18-19-41)24-38(46)47)22-32-14-11-28-10-13-31(42)21-34(28)43-32/h3-11,13-14,20-21,35-36,48H,12,15-19,22-26H2,1-2H3,(H,44,45)(H,46,47)/t35-,36+/m1/s1 |
| InChI Key | SJNODSMYYCYZTO-XDSPJLLDSA-N |
| NACRES Code | NA.24 |
| UNSPSC | 41116107 |
| Transport Info | Product Name: Montelukast Impurity E |
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