59989-20-7 theo-Hexanicit 7-Acetyl-3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione, compound with 6-amino-2-methylheptan-2-ol (1:1) 1H-Purine-2,6-dione, 7-acetyl-3,7-dihydro-1,3-dimethyl-, compd with 6-amino-2-methyl-2-heptanol (1:1) 2-Heptanol, 6-amino-2-methyl-, compd with 7-acetyl-3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione (1:1) EINECS 262-012-4 7-Theophyllinessigsaeure-(6-amino-2-methyl-2-heptyl)-ester Heptaminol Theo-Heptylon Cariamyl Corophylline Heptaminol etaphyllinate CAS 59989-20-7

Purity 97%+In StockPharmaceutical Standards
CAS No.59989-20-7
Molecular FormulaC9H10N4O3
Molecular WeightN/A
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

59989-20-7
theo-Hexanicit
7-Acetyl-3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione, compound with 6-amino-2-methylheptan-2-ol (1:1)
1H-Purine-2,6-dione, 7-acetyl-3,7-dihydro-1,3-dimethyl-, compd with 6-amino-2-methyl-2-heptanol (1:1)
2-Heptanol, 6-amino-2-methyl-, compd with 7-acetyl-3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione (1:1)
EINECS 262-012-4
7-Theophyllinessigsaeure-(6-amino-2-methyl-2-heptyl)-ester
Heptaminol
Theo-Heptylon
Cariamyl
Corophylline
Heptaminol etaphyllinate CAS 59989-20-7 chemical structure

Description

59989-20-7 theo-Hexanicit 7-Acetyl-3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione, compound with 6-amino-2-methylheptan-2-ol (1:1) 1H-Purine-2,6-dione, 7-acetyl-3,7-dihydro-1,3-dimethyl-, compd with 6-amino-2-methyl-2-heptanol (1:1) 2-Heptanol, 6-amino-2-methyl-, compd with 7-acetyl-3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione (1:1) EINECS 262-012-4 7-Theophyllinessigsaeure-(6-amino-2-methyl-2-heptyl)-ester Heptaminol Theo-Heptylon Cariamyl Corophylline Heptaminol etaphyllinate (C9H10N4O3C8H19NO) contains a steroid core, an amide group, a hydroxyl group, an ether linkage. It is notably hygroscopic, the carboxyl group imparts weak acidity; these physicochemical properties determine the optimal preparation and storage of its standard solutions. The presence of an aromatic ring or conjugated system gives the compound characteristic absorption bands in the UV-Vis region, making it well suited to UV or diode-array detection (DAD).

59989-20-7 theo-Hexanicit 7-Acetyl-3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione, compound with 6-amino-2-methylheptan-2-ol (1:1) 1H-Purine-2,6-dione, 7-acetyl-3,7-dihydro-1,3-dimethyl-, compd with 6-amino-2-methyl-2-heptanol (1:1) 2-Heptanol, 6-amino-2-methyl-, compd with 7-acetyl-3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione (1:1) EINECS 262-012-4 7-Theophyllinessigsaeure-(6-amino-2-methyl-2-heptyl)-ester Heptaminol Theo-Heptylon Cariamyl Corophylline Heptaminol etaphyllinate (CAS 59989-20-7), molecular formula C9H10N4O3C8H19NO and molecular weight 367.45 g/mol, is a CATO reference standard with documented purity and traceability.

This reference standard is suitable for quantitative analysis on major chromatographic platforms including HPLC, GC, LC-MS/MS, and GC-MS, serving as an external calibration standard or a system suitability test reference material.

The assigned purity is verified by mass-balance and quantitative NMR (qNMR) approaches, with the expanded uncertainty reported at a 95% confidence level (k=2). Batch homogeneity and stability are independently assessed for every lot.

Physical & Chemical Properties

Molecular FormulaC9H10N4O3 C8H19NO
Molecular Weight367.45 g/mol
AppearanceOff-white to pale yellow crystalline powder
Purity97%+
StorageStore at 2-8°C, protect from light, keep sealed and dry
Solubility (reference)Soluble in DMSO, DMF, methanol
StabilityMay oxidize slowly on prolonged air exposure; Light-sensitive; avoid direct strong light; Hygroscopic; reseal immediately after opening
Degree of Unsaturation (DBE)6.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)1974
Nitrogen Atoms5

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