CAS No. 171482-05-6

 

Product Information

Chemical Formula: C20H19ClF7NO2
Molecular Weight:473.81
Synonyms:(2R,3S)-2-{(1R)-1-[3,5-Bis(Trifluoromethyl)Phenyl]Ethoxy}-3-(4-Fluorophenyl)Morpholine Hydrochloride; (2R,3S)-2-[(1R)-1-[3,5-Bis(Trifluoromethyl)Phenyl]Ethoxy]-3-(4-Fluorophenyl)Morpholine Hydrochloride (1:1); Aprepitant Intermediates; Aprepitant Hcl; (2R,3S)-2-((R)-1-(3,5-Bis(Trifluoromethyl)Phenyl)Ethoxy)-3-(4-Fluorophenyl)Morpholine Hydrochloride; (2R, 3S)-2-(1R)-1-(3, 5-Bis (Trifluoromethyl)-3-(4-Fluorophenyl) Morpholine Hydrochloride; (2R,3S)-2-((R)-1-(3,5-Bis(Trifluoromethyl)Phenyl)-Ethoxy)-3-(4-Fluorophenyl)Morpholine Hydrochlor; Morpholine, 2-[(1R)-1-[3,5-Bis(Trifluoromethyl)Phenyl]Ethoxy]-3-(4-Fluorophenyl)-, Hydrochloride (1:1), (2R,3S)-
MDL No.:MFCD13183776
EINECS / EC No.:N/A
Pubchem CID:10116311
IUPAC Name:(2R,3S)-2-[(1R)-1-[3,5-bis(trifluoromethyl)phenyl]ethoxy]-3-(4-fluorophenyl)morpholine;hydrochloride
Standard InchI:InChI=1S/C20H18F7NO2.ClH/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;/h2-5,8-11,17-18,28H,6-7H2,1H3;1H/t11-,17+,18-;/m1./s1
InchI Key:DWCCMKXSGCKMJF-YNXGUESPSA-N
SMILES:CC(C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)OC2C(NCCO2)C3=CC=C(C=C3)F.Cl
Appearance:-
Melting Point:N/A
Boiling Point:387.9 °C at 760 mmHg
Density (Theoretical):N/A

Safety Information

Signal Word: Warning
Hazard Statements:H302-H315-H319-H335
Precautionary Statements:P261-P305+P351+P338
Flash Point:188.4 °C
Transportation Information:N/A
GHS Pictograms:Exclamation Mark - GHS07