benzyl hydrogen (3-(((2R,3S)-2-((R)-1-(3,5-bis(trifluoromethyl)phenyl)ethoxy)-3-(4-fluorophenyl)morpholino)methyl)-5-imino-4,5-dihydro-1H-1,2,4-triazol-1-yl)phosphonate

Modify Date: 2024-01-16 10:08:27

benzyl hydrogen (3-(((2R,3S)-2-((R)-1-(3,5-bis(trifluoromethyl)phenyl)ethoxy)-3-(4-fluorophenyl)morpholino)methyl)-5-imino-4,5-dihydro-1H-1,2,4-triazol-1-yl)phosphonate structure	Common Name	benzyl hydrogen (3-(((2R,3S)-2-((R)-1-(3,5-bis(trifluoromethyl)phenyl)ethoxy)-3-(4-fluorophenyl)morpholino)methyl)-5-imino-4,5-dihydro-1H-1,2,4-triazol-1-yl)phosphonate
	CAS Number	889852-02-2	Molecular Weight	704.52900
	Density	1.51±0.1 g/cm3 (20 ºC 760 Torr)	Boiling Point	N/A
	Molecular Formula	C₃₀H₂₈F₇N₄O₆P	Melting Point	N/A
	MSDS	N/A	Flash Point	N/A

Name	Fosaprepitant Impurity 16
Synonym	More Synonyms

Density	1.51±0.1 g/cm3 (20 ºC 760 Torr)
Molecular Formula	C₃₀H₂₈F₇N₄O₆P
Molecular Weight	704.52900
Exact Mass	704.16300
PSA	128.72000
LogP	6.52870
Water Solubility	Insuluble (1.1E-3 g/L) (25 ºC)

[3-[[(2R,3S)-2-[(1R)-1-[3,5-Bis(trifluoromethyl)phenyl]ethoxy]-3-(4-fluorophenyl)-4-morpholinyl]methyl]-2,5-dihydro-5-oxo-1H-1,2,4-triazol-1-yl]phosphonic acid mono(phenylmethyl) ester

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