Cafedrine

Name: Cafedrine
Brand: Vaqora Chemicals
SKU: VQ-021039

About Cafedrine

Vaqora Chemicals supplies Cafedrine, a high-purity reference standard of Cafedrine registered under CAS number 58166-83-9. Its molecular formula is C18H23N5O3 and its molecular weight is 357.4 g/mol. Systematically, it is named 7-[2-[[(1R,2S)-1-hydroxy-1-phenylpropan-2-yl]amino]ethyl]-1,3-dimethylpurine-2,6-dione. It is also known as Cafedrin or l-Cafedrine.

It is supplied as a solid. Reference materials should be stored sealed and away from light and moisture, as specified on the accompanying COA. Good laboratory practice and suitable PPE are recommended during handling.

As a reference sample of Cafedrine, it is used for identification, assay and impurity-profiling work during analytical method development, validation (AMV) and routine QC. Typical end-use sectors are pharmaceutical manufacturing and academic and industrial research.

Vaqora Chemicals supplies Cafedrine in 10 mg, 25 mg, 50 mg and 100 mg packs, each shipped with a Certificate of Analysis (COA), and exports worldwide.

Typical applications

Identification & assay
Method development & validation
QC reference material

Industries

Related to Cafedrine

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

Cafedrine impurities

Specifications & identifiers

Chemical identifiers
Product name	Cafedrine
Catalogue No.	VQ-021039
CAS Number	58166-83-9
IUPAC name	7-[2-[[(1R,2S)-1-hydroxy-1-phenylpropan-2-yl]amino]ethyl]-1,3-dimethylpurine-2,6-dione
Molecular formula	C₁₈H₂₃N₅O₃
Molecular weight	357.4 g/mol
Exact mass	357.1801
Grade	Reference Standard
HSN code	38229090
InChIKey	UJSKUDDDPKGBJY-WFASDCNBSA-N
SMILES	C[C@@H]([C@@H](C1=CC=CC=C1)O)NCCN2C=NC3=C2C(=O)N(C(=O)N3C)C
PubChem CID	5489638

Physical properties
Physical form	Solid
LogP (XLogP3)	0.3
H-bond donors / acceptors	2 / 5
TPSA	90.7 Å²
Synonyms	7-(2-(beta-Hydroxy-alpha-methylphenethylamino)ethyl)theophylline, 7-(2-(1-methyl-2-hydroxy-2-phenylethylamino)ethyl)theophylline, Cafedrin, l-Cafedrine, 7-(2-(2-Hydroxy-1-methylphenethylamino)ethyl)theophylline, Theophylline, 7-(2-(beta-hydroxy-alpha-methylphenethylamino)ethyl)-, 58166-83-9 (free base)

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 Cafedrine?

The CAS Registry Number of Cafedrine is 58166-83-9. It is also known as 7-(2-(beta-Hydroxy-alpha-methylphenethylamino)ethyl)theophylline, 7-(2-(1-methyl-2-hydroxy-2-phenylethylamino)ethyl)theophylline, Cafedrin.

What is the molecular formula and molecular weight of Cafedrine?

Cafedrine has the molecular formula C18H23N5O3 and a molecular weight of 357.4 g/mol. Its IUPAC name is 7-[2-[[(1R,2S)-1-hydroxy-1-phenylpropan-2-yl]amino]ethyl]-1,3-dimethylpurine-2,6-dione.

What is Cafedrine used for?

Cafedrine is supplied as a characterised reference material related to Cafedrine. 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 Cafedrine can I order?

We supply Cafedrine 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 Cafedrine?

Yes. Every lot of Cafedrine 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 Cafedrine be shipped internationally?

Yes. We export Cafedrine worldwide by air and sea freight or express courier, on EXW, FOB, CIF, CFR or DAP Incoterms, with full export documentation.