Chemical Name | Aprepitant Impurity B Enantiomer Hydrochloride |
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CAT No. | CS-P-07154 |
CAS Registry# | 183901-47-5 |
Status | |
Category | Impurities |
Hazardous | This is not a Hazardous Compound |
COA | View Sample COA |
MSDS | View Sample MSDS |
Controlled | No |
Controlled | No |
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Parent API | Aprepitant |
Therapeutic | Anti-Cancer / Oncology |
Canonical Smiles | CC(C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)OC2C(N(CCO2)CC3=CC=CC=C3)C4=CC=C(C=C4)F.Cl |
InchIKey | BZQVUGFKUGRXJT-BPRFSPGLSA-N |
Inchl | InChI=1S/C27H24F7NO2.ClH/c1-17(20-13-21(26(29,30)31)15-22(14-20)27(32,33)34)37-25-24(19-7-9-23(28)10-8-19)35(11-12-36-25)16-18-5-3-2-4-6-18;/h2-10,13-15,17,24-25H,11-12,16H2,1H3;1H/t17-,24+,25-;/m1./s1 |
IUPAC | (2R,3S)-4-benzyl-2-[(1R)-1-[3,5-bis(trifluoromethyl)phenyl]ethoxy]-3-(4-fluorophenyl)morpholine;hydrochloride |
Hazardous | No |
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