
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 200000-59-5 |
| Catalog No. | 2A-0095158 |
| Chinese Name | (2R,3S)-2-[(1R)-1-[3,5-双(三氟甲基)苯基]乙氧基]-3-(4-氟苯基)吗啉对苯甲磺酸盐 |
| Synonyms | Exact Mass 609.141968; PSA 93.24000; LogP 8.27940; InChIKey SQSDKFVTNMLFGV-YNXGUESPSA-N |
| Molecular Formula | C27H26O5N1S1F7 |
| Molecular Weight | 609.56 |
| Purity | 96+ |
| Appearance | White to off-white solid |
| Storage Condition | room temperature, dry |
| EINECS | 0 |
| HTC | 0 |
| UN(IATA) | 0 |
| PubChem ID | 16694955 |
| MDL Number | MFCD13183777 |
| SMILES | CC(OC1OCCNC1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1.Cc1ccc(S(=O)(=O)O)cc1 |
| InChI | InChI=1S/C20H18F7NO2.C7H8O3S/c1-11(13-8-14(19(22,23)24)10-15(9-13)20(25,26)27)30-18-17(28-6-7-29-18)12-2-4-16(21)5-3-12;1-6-2-4-7(5-3-6)11(8,9)10/h2-5,8-11,17-18,28H,6-7H2,1H3;2-5H,1H3,(H,8,9,10)/t11-,17+,18-;/m1./s1 |
| InChI Key | SQSDKFVTNMLFGV-YNXGUESPSA-N |
| MSDS | msds/95158_1_200000_59_5.pdf |
| Transport Info | Product name: (2R, 3S)-2-[(1R)-1-[3,5-bis(trifluoromethyl)phenyl]ethoxy]-3-(4-fluorophenyl)morpholine p-benzenesulfonate (aripitant intermediate sulfonate) |
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