Products 502537-39-5

CAS 502537-39-5 is the registry number for Aprepitant Impurity 41. Offered by: Chemat Brand. Available pack sizes: on request.

Structural formula: {0} (CAS {1})

(1S,2R)-2-(2-aminoethoxy)-2-[(1R)-1-[3,5-bis(trifluoromethyl)phenyl]ethoxy]-1-(4-fluorophenyl)ethanol (CAS 502537-39-5) is a chemical compound with the molecular formula C20H20F7NO3 and a molecular weight of 455.4 g/mol. IUPAC name: (1S,2R)-2-(2-aminoethoxy)-2-[(1R)-1-[3,5-bis(trifluoromethyl)phenyl]ethoxy]-1-(4-fluorophenyl)ethanol. InChIKey: OOWHJXHLOMLHQO-CNOZUTPLSA-N.

Identity
Molecular formulaC20H20F7NO3
Molecular weight455.4 g/mol
IUPAC name(1S,2R)-2-(2-aminoethoxy)-2-[(1R)-1-[3,5-bis(trifluoromethyl)phenyl]ethoxy]-1-(4-fluorophenyl)ethanol
InChIKeyOOWHJXHLOMLHQO-CNOZUTPLSA-N
SMILESC[C@H](C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)O[C@H]([C@H](C2=CC=C(C=C2)F)O)OCCN

Computed by PubChem (NCBI)