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ChemicalBook--->CAS DataBase List--->1148113-53-4

1148113-53-4

1148113-53-4 Structure

1148113-53-4 Structure
IdentificationBack Directory
[Name]

(R,R,R)-Aprepitant
[CAS]

1148113-53-4
[Synonyms]

Aprepitant A
(R,R,R)-Aprepitant
(1R,2R,3R)-Aprepitant
Aprepitant EP Impurity E
Aprepitant trans-1-enantiomer
Aprepitant Related CoMpound A
Aprepitant USP RC A (R,R,R-Diasteromer)
Aprepitant impurity 5/Aprepitant EP Impurity E
Aripitant related substance A reference substance
3-(((2R,3R)-2-((R)-1-(3,5-bis(trifluoromethyl)phenyl)ethoxy)-3-(4-fluorophenyl)morpholino)methyl)-1H-1,2,4-triazol-5(4H)-one
5-(((2R,3R)-2-((R)-1-(3,5-bis(trifluoromethyl)phenyl)ethoxy)-3-(4-fluorophenyl)morpholino)methyl)-2,4-dihydro-3H-1,2,4-triazol-3-one
5-[[(2R,3R)-2-[(1R)-1-[3,5-Bis(trifluoroMethyl)phenyl]ethoxy]-3-(4-fluorophenyl)-4-Morpholinyl]Methyl]-1,2-dihydro-3H-1,2,4-triazol-3-one
3H-1,2,4-Triazol-3-one, 5-[[(2R,3R)-2-[(1R)-1-[3,5-bis(trifluoromethyl)phenyl]ethoxy]-3-(4-fluorophenyl)-4-morpholinyl]methyl]-1,2-dihydro-
Aprepitant Related Compound A (10 mg) (3-[[(2R,3R)-2-[(R)-1-[3,5-Bis(trifluoromethyl)phenyl]ethoxy]-3-(4-fluorophenyl)morpholino]methyl]-1H-1,2,4-triazol-5(4H)-one)
[Molecular Formula]

C23H21F7N4O3
[MDL Number]

MFCD23704633
[MOL File]

1148113-53-4.mol
[Molecular Weight]

534.43
Chemical PropertiesBack Directory
[density ]

1.51±0.1 g/cm3(Predicted)
[pka]

8.06±0.20(Predicted)
Safety DataBack Directory
[Symbol(GHS) ]


GHS07
[Signal word ]

Warning
[Hazard statements ]

H413-H302
[Precautionary statements ]

P264-P270-P301+P312-P330-P501
[HS Code ]

2934990002
Hazard InformationBack Directory
[Uses]

The (R,R,R)-enantiomer of Aprepitant (A729800,1148113-53-4), the key intermediate of Aprepitant in bulk drug and formulation samples of Aprepitant.
[Application]

(R,R,R)-Aprepitant (Aprepitant Related Compound A,1148113-53-4) is a USP reference standard, intended for use in specified quality tests and assays as specified in the USP compendia.
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