Brucine sulphate, 98%

About Brucine sulphate, 98%

Brucine sulphate is a chiral building block in Puriss grade carrying the CAS registry number 4845-99-2 with a typical assay of ≥98%. The compound has the formula C46H54N4O12S, corresponding to a molecular weight of 887.0 g/mol. Alternative names: Brucine sulfate heptahydrate and Brucine Sulfate.

In its supplied form it is white to off-white powder or crystals or chunks. Key physical data: a melting point of 180 °C. Keep the container tightly sealed and store it in a cool, dry area. Under GHS it is labelled “Danger”, so handle it with suitable PPE and consult the SDS.

Key uses span organic synthesis and API synthesis. Buyers come mainly from pharmaceutical manufacturing and academic and industrial research.

Available in 25 g, 250 g, 1 kg and 5 kg packs, Brucine sulphate is dispatched with a Certificate of Analysis (COA) to destinations worldwide.

Typical applications

Organic synthesis
API synthesis

Industries

Specifications & identifiers

Chemical identifiers
Product name	Brucine sulphate, 98%
Catalogue No.	VQ-011274
CAS Number	4845-99-2
IUPAC name	bis((4aR,5aS,8aR,13aS,15aS,15bR)-10,11-dimethoxy-4a,5,5a,7,8,13a,15,15a,15b,16-decahydro-2H-4,6-methanoindolo[3,2,1-ij]oxepino[2,3,4-de]pyrrolo[2,3-h]quinolin-14-one);sulfuric acid
Molecular formula	C₄₆H₅₄N₄O₁₂S
Molecular weight	887 g/mol
Exact mass	886.3459
Grade	Puriss
Purity / assay	≥98%
HSN code	29398000
InChIKey	HCMSIGALSOEZRW-WIMNQIPBSA-N
SMILES	COC1=C(C=C2C(=C1)[C@]34CCN5[C@H]3C[C@@H]6[C@@H]7[C@@H]4N2C(=O)C[C@@H]7OCC=C6C5)OC.COC1=C(C=C2C(=C1)[C@]34CCN5[C@H]3C[C@@H]6[C@@H]7[C@@H]4N2C(=O)C[C@@H]7OCC=C6C5)OC.OS(=O)(=O)O
PubChem CID	24721400

Physical properties
Physical form	Crystalline
Appearance	White to off-white powder or crystals or chunks
Melting point	180 °C
H-bond donors / acceptors	2 / 14
TPSA	185 Å²
UN number	UN 1544
Synonyms	Brucine sulfate heptahydrate, Brucine Sulfate, Brucine sulfate anhydrous, Brucine sulphate anhydrous, Strychnidin-10-one, 2,3-dimethoxy-, sulfate (2:1), Brucine sulfate [NF], Brucine sulfate (VAN), Brucine, sulfate (2:1), Brucine sulphate (2:1), Dimethoxy strychnine sulfate, 2,3-Dimethoxystrychnidin-10-one sulfate (2:1), Sulfuric acid--2,3-dimethoxystrychnidin-10-one (1/2)

Safety & hazard information (GHS)

Toxic

Signal word: Danger

Hazard statements

H300Fatal if swallowed
H330Fatal if inhaled
H412Harmful to aquatic life with long lasting effects

Precautionary statements: P260, P264, P270, P271, P273, P284, P301 + P316, P304 + P340, P316, P320, P321, P330, P403 + P233, P405, P501

Classification is indicative (aggregated GHS notifications) and may vary by grade and concentration. Always refer to the SDS supplied with your lot.

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 Brucine sulphate, 98%?

The CAS Registry Number of Brucine sulphate, 98% is 4845-99-2. It is also known as Brucine sulfate heptahydrate, Brucine Sulfate, Brucine sulfate anhydrous.

What is the molecular formula and molecular weight of Brucine sulphate, 98%?

Brucine sulphate, 98% has the molecular formula C46H54N4O12S and a molecular weight of 887 g/mol.

Which grade and pack sizes of Brucine sulphate, 98% can I order?

We supply Brucine sulphate, 98% in Puriss (≥98%) grade, in 25 g, 250 g, 1 kg, 5 kg packs. Larger bulk quantities and custom packing are quoted on request.

Do you provide a COA and SDS with Brucine sulphate, 98%?

Yes. Every lot of Brucine sulphate, 98% 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 Brucine sulphate, 98% be shipped internationally?

Yes. Brucine sulphate, 98% is classified as hazardous (UN 1544), so it is packed in UN-approved packaging and shipped as dangerous goods under IATA/IMDG rules. We export worldwide on EXW, FOB, CIF and DAP terms.