8-(1-Methyl-4-piperidyl)theophylline hydrochloride

Base Information

• Chemical Name: 8-(1-Methyl-4-piperidyl)theophylline hydrochloride
• CAS No.: 964-56-7
• Molecular Formula: C13H20ClN5O2
• Molecular Weight: 313.7832
• DSSTox Substance ID: DTXSID90914541

Synonyms:964-56-7;8-(1-Methyl-4-piperidyl)theophylline hydrochloride;Chlorhydrate de N methyl piperidyl-4' theophylline [French];Theophylline, 8-(1-methyl-4-piperidyl)-, hydrochloride;DTXSID90914541;Chlorhydrate de N methyl piperidyl-4' theophylline;1,3-Dimethyl-8-(1-methylpiperidin-4-yl)-3,9-dihydro-1H-purine-2,6-dione--hydrogen chloride (1/1)

Chemical Property of 8-(1-Methyl-4-piperidyl)theophylline hydrochloride

Chemical Property:

• Vapor Pressure: 6.32E-11mmHg at 25°C
• Boiling Point: 520.3°Cat760mmHg
• Flash Point: 268.5°C
• Density: g/cm³
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 1
• Exact Mass: 313.1305526
• Heavy Atom Count: 21
• Complexity: 421

Purity/Quality:

8-(1-METHYL-4-PIPERIDYL)THEOPHYLLINE HYDROCHLORIDE 95.00% ^*data from reagent suppliers

Safty Information:

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MSDS Files:

Useful:

• Canonical SMILES: CN1CCC(CC1)C2=NC3=C(N2)C(=O)N(C(=O)N3C)C.Cl

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