Fosaprepitant

Catalog Number: EI-1001

CAS Number: 172673-20-0

Specifications Downloads Related products

Specifications

Product Information
Molecular Formula	C₂₃H₂₂F₇N₄O₆P
Molecular Weight	614.41
Purity	≥98% by HPLC
SMILES	CC(C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)OC2C(N(CCO2)CC3=NC(=O)N(N3)P(=O)(O)O)C4=CC=C(C=C4)F
InChi	InChI=1S/C23H22F7N4O6P/c1-12(14-8-15(22(25,26)27)10-16(9-14)23(28,29)30)40-20-19(13-2-4-17(24)5-3-13)33(6-7-39-20)11-18-31-21(35)34(32-18)41(36,37)38/h2-5,8-10,12,19-20H,6-7,11H2,1H3,(H,31,32,35)(H2,36,37,38)/t12-,19+,20-/m1/s1
InChi Key	BARDROPHSZEBKC-OITMNORJSA-N
Alternate Name	P-[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; L 758298
Appearance	White solid

Properties
Storage Conditions	-20°C
Shipping Conditions	Gel Pack
Solubility	DMSO

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