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· · COA & SDS available for every product · Same-day shipping on in-stock items Brucine Sulfate Heptahydrate[for Nitrate Analysis] - ACS , CAS No.60583-39-3
GRADE & PURITY ACS ? ACS grade — meets American Chemical Society specifications, the analytical benchmark in the US. Use for analytical and QC work needing ACS-defined purity. Synonyms
Q27285491 | Brucine sulfate heptahydrate, ACS reagent | brucine sulphate heptahydrate | UNII-O900CDH328 | 2,3-Dimethoxystrychnidin-10-one sulfate (1:1) heptahydrate | Brucine sulphate | 10,11-DIMETHOXYSTRYCHNINE SULPHATE HEPTAHYDRATE | (4aR,5aS,8aR,13aS,1
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Why this grade ACS ACS for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
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Storage & shipping Room temperature Ships FedEx DG Service Check lot-specific COA for exact specifications.
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Quality documents SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.
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Literature proof Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
Specifications Synonyms
Q27285491 | Brucine sulfate heptahydrate, ACS reagent | brucine sulphate heptahydrate | UNII-O900CDH328 | 2, 3-Dimethoxystrychnidin-10-one sulfate (1:1) heptahydrate | Brucine sulphate | 10, 11-DIMETHOXYSTRYCHNINE SULPHATE HEPTAHYDRATE | (4aR, 5aS, 8aR, 13aS, 1
Specifications & Purity
ACS
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This product requires cold chain shipping. Ground and other economy services are not available.
Names and Identifiers Canonical Smiles COC1=C(C=C2C(=C1)C34CCN5C3CC6C7C4N2C(=O)CC7OCC=C6C5)OC.COC1=C(C=C2C(=C1)C34CCN5C3CC6C7C4N2C(=O)CC7OCC=C6C5)OC.O.O.O.O.O.O.O.OS(=O)(=O)O IUPAC Name (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;heptahydrate InChIKey PPJIVFYMRNHHTJ-JYGVWXPPSA-N INCHI 1S/2C23H26N2O4.H2O4S.7H2O/c2*1-27-16-8-14-15(9-17(16)28-2)25-20(26)10-18-21-13-7-19-23(14,22(21)25)4-5-24(19)11-12(13)3-6-29-18;1-5(2,3)4;;;;;;;/h2*3,8-9,13,18-19,21-22H,4-7,10-11H2,1-2H3;(H2,1,2,3,4);7*1H2/t2*13-,18-,19-,21-,22-,23+;;;;;;;;/m00......../s1 Isomeric 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.O.O.O.O.O.O.O.OS(=O)(=O)O RTECS WL2103350 PubChem CID 16211665 Molecular Weight 1013.12 Beilstein 27(2)802 Reaxy-Rn 3875567
Documentation 📋 Safety Data Sheet (SDS) Comprehensive hazard, handling, storage, and regulatory compliance document.
Download SDS → ✅ Certificate of Analysis (COA) Lot-specific quality data. Enter your lot number to retrieve the exact COA.
Look up COA → 📊 Datasheet Quick-reference summary of product specifications and applications.
View datasheet → 🔬 Specification Sheet Full quality attributes and acceptance criteria for this grade.
View spec sheet →
Advanced Data Taxonomic Classification Kingdom Organic compounds Superclass Alkaloids and derivatives Class Strychnos alkaloids Subclass Not available Intermediate Tree Nodes Not available Direct Parent Strychnos alkaloids Alternative Parents Carbazoles Quinolidines Indolizidines Anisoles Piperidinones Delta lactams Aralkylamines Alkyl aryl ethers Organic sulfuric acids N-alkylpyrrolidines Tertiary carboxylic acid amides Trialkylamines Amino acids and derivatives Oxacyclic compounds Dialkyl ethers Azacyclic compounds Organopnictogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds Molecular Framework Not available Substituents Strychnan skeleton - Akuammicine-skeleton - Stemmadenine-skeleton - Carbazole - Quinolidine - Indolizidine - Indole or derivatives - Phenol ether - Anisole - Aralkylamine - Piperidinone - Sulfuric acid - Delta-lactam - Alkyl aryl ether - Benzenoid - N-alkylpyrrolidine - Piperidine - Tertiary carboxylic acid amide - Pyrrolidine - Organic sulfuric acid or derivatives - Tertiary aliphatic amine - Tertiary amine - Lactam - Carboxamide group - Amino acid or derivatives - Oxacycle - Azacycle - Organoheterocyclic compound - Ether - Dialkyl ether - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Carbonyl group - Amine - Aromatic heteropolycyclic compound Description This compound belongs to the class of organic compounds known as strychnos alkaloids. These are alkaloids having a core structure based on the strychnan, stemmadenine (seco-curan), or the akuammicine (curan) skeleton. External Descriptors Not available Data sources 1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.
3D Structure Certificates（CoA,COO,BSE/TSE and Analysis Chart) Chemical and Physical Properties Solubility Soluble in water ; slightly soluble in chloroform, alcohol Specific Rotation[α] -26° (C=1,H2O) Melt Point(°C) 180 °C(dec.) Molecular Weight 1013.100 g/mol XLogP3 Hydrogen Bond Donor Count 9 Hydrogen Bond Acceptor Count 21 Rotatable Bond Count 4 Exact Mass 1012.42 Da Monoisotopic Mass 1012.42 Da Topological Polar Surface Area 192.000 Ų Heavy Atom Count 70 Formal Charge 0 Complexity 866.000 Isotope Atom Count 0 Defined Atom Stereocenter Count 12 Undefined Atom Stereocenter Count 0 Defined Bond Stereocenter Count 0 Undefined Bond Stereocenter Count 0 The total count of all stereochemical bonds 0 Covalently-Bonded Unit Count 10
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