Aprepitant M3 Metabolite (1R, 5S, 6R)-Isomer 419574-04-2

Name: Aprepitant M3 Metabolite (1R, 5S, 6R)-Isomer
Brand: Vaqora Chemicals
SKU: VQ-035083

About Aprepitant M3 Metabolite (1R, 5S, 6R)-Isomer

Aprepitant M3 Metabolite (1R, 5S, 6R)-Isomer (CAS 419574-04-2) is a metabolite or degradation product of Aprepitant offered by Vaqora Chemicals. Formula C20H16F7NO3, molecular weight 451.3 g/mol. Systematically, it is named (5S,6R)-6-[(1R)-1-[3,5-bis(trifluoromethyl)phenyl]ethoxy]-5-(4-fluorophenyl)morpholin-3-one. Alternative names: Aprepitant M3 Metabolite (1R, 5R, 6S)-Isomer and Aprepitant-M3 Metabolite.

The product is provided as a solid. Keep the vial tightly closed, protected from light and humidity, at the temperature stated on the Certificate of Analysis. Handle it with standard laboratory precautions and appropriate personal protective equipment.

It is used in metabolite identification, stability-indicating method development and impurity profiling of Aprepitant, as well as in QC testing and ANDA/DMF documentation. Buyers come mainly from pharmaceutical manufacturing and academic and industrial research.

Standard pack sizes are 10 mg, 25 mg, 50 mg and 100 mg, and every batch ships with a Certificate of Analysis (COA) and we export worldwide.

Typical applications

Metabolite identification
Stability-indicating methods
Impurity profiling

Industries

Related to Aprepitant

View every impurity, metabolite and intermediate we list for Aprepitant.

Aprepitant impurities

Specifications & identifiers

Chemical identifiers
Product name	Aprepitant M3 Metabolite (1R, 5S, 6R)-Isomer
Catalogue No.	VQ-035083
CAS Number	419574-04-2
IUPAC name	(5S,6R)-6-[(1R)-1-[3,5-bis(trifluoromethyl)phenyl]ethoxy]-5-(4-fluorophenyl)morpholin-3-one
Molecular formula	C₂₀H₁₆F₇NO₃
Molecular weight	451.3 g/mol
Exact mass	451.1018
Grade	Reference Standard
HSN code	38229090
InChIKey	UISOBKKSNVFVOF-KTTLUUMZSA-N
SMILES	C[C@H](C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)O[C@@H]2[C@@H](NC(=O)CO2)C3=CC=C(C=C3)F
PubChem CID	9933512

Physical properties
Physical form	Solid
LogP (XLogP3)	4.5
H-bond donors / acceptors	1 / 10
TPSA	47.6 Å²
Synonyms	Aprepitant M3 Metabolite (1R, 5R, 6S)-Isomer, Aprepitant-M3 Metabolite, Aprepitant Impurity 45, (5S,6R)-6-((R)-1-(3,5-bis(trifluoromethyl)phenyl)ethoxy)-5-(4-fluorophenyl)morpholin-3-one, [Aprepitant-M3], (5S,6R)-6-((1R)-1-(3,5-bis(trifluoromethyl)phenyl)ethoxy)-5-(4-fluorophenyl)3-morpholinone

Documents

Safety Data Sheet (SDS)16-section GHS · on request Certificate of AnalysisTypical / batch COA · on request Specification sheetTDS / MOA · on request

Frequently asked questions

What is the CAS number of Aprepitant M3 Metabolite (1R, 5S, 6R)-Isomer?

The CAS Registry Number of Aprepitant M3 Metabolite (1R, 5S, 6R)-Isomer is 419574-04-2. It is also known as Aprepitant M3 Metabolite (1R, 5R, 6S)-Isomer, Aprepitant-M3 Metabolite, Aprepitant Impurity 45.

What is the molecular formula and molecular weight of Aprepitant M3 Metabolite (1R, 5S, 6R)-Isomer?

Aprepitant M3 Metabolite (1R, 5S, 6R)-Isomer has the molecular formula C20H16F7NO3 and a molecular weight of 451.3 g/mol. Its IUPAC name is (5S,6R)-6-[(1R)-1-[3,5-bis(trifluoromethyl)phenyl]ethoxy]-5-(4-fluorophenyl)morpholin-3-one.

What is Aprepitant M3 Metabolite (1R, 5S, 6R)-Isomer used for?

Aprepitant M3 Metabolite (1R, 5S, 6R)-Isomer is supplied as a characterised reference material related to Aprepitant. It is used for analytical method development and validation (AMV), impurity profiling, stability studies and quality control, and in ANDA/DMF regulatory filings.

Which grade and pack sizes of Aprepitant M3 Metabolite (1R, 5S, 6R)-Isomer can I order?

We supply Aprepitant M3 Metabolite (1R, 5S, 6R)-Isomer in Reference Standard grade, in 10 mg, 25 mg, 50 mg, 100 mg packs. Larger bulk quantities and custom packing are quoted on request.

Do you provide a COA and SDS with Aprepitant M3 Metabolite (1R, 5S, 6R)-Isomer?

Yes. Every lot of Aprepitant M3 Metabolite (1R, 5S, 6R)-Isomer is shipped with a batch-specific Certificate of Analysis, and a 16-section GHS Safety Data Sheet is provided with the quotation and the shipment.

Can Aprepitant M3 Metabolite (1R, 5S, 6R)-Isomer be shipped internationally?

Yes. We export Aprepitant M3 Metabolite (1R, 5S, 6R)-Isomer worldwide by air and sea freight or express courier, on EXW, FOB, CIF, CFR or DAP Incoterms, with full export documentation.