7-beta-Piperazinoethyltheophylline dihydrochloride

Base Information

• Chemical Name: 7-beta-Piperazinoethyltheophylline dihydrochloride
• CAS No.: 53499-66-4
• Molecular Formula: C13H20N6O2
• Molecular Weight: 292.3369
• UNII: 1H478E3OJP
• DSSTox Substance ID: DTXSID70201709
• Mol file: 53499-66-4.mol

Synonyms:7-beta-Piperazinoethyltheophylline dihydrochloride;53499-66-4;NSC 338290;1H-Purine-2,6-dione, 3,7-dihydro-1,3-dimethyl-7-(2-(1-piperazinyl)ethyl)-, dihydrochloride;1H478E3OJP;Theophylline, 7-(2-(1-piperazinyl)ethyl)-, dihydrochloride;NSC-338290;UNII-1H478E3OJP;C13H20N6O2.2ClH;DTXSID70201709;AKOS026017181;C13-H20-N6-O2.2Cl-H;LS-126942;1,3-Dimethyl-7-(2-(piperazin-1-yl)ethyl)-1H-purine-2,6(3H,7H)-dione dihydrochloride;1,3-dimethyl-7-[2-(piperazin-1-yl)ethyl]-2,3,6,7-tetrahydro-1H-purine-2,6-dione dihydrochloride

Chemical Property of 7-beta-Piperazinoethyltheophylline dihydrochloride

Chemical Property:

• Vapor Pressure: 1.1E-11mmHg at 25°C
• Boiling Point: 539°Cat760mmHg
• Flash Point: 279.8°C
• Density: 1.44g/cm³
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 3
• Exact Mass: 364.1181294
• Heavy Atom Count: 23
• Complexity: 425

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CCN3CCNCC3.Cl.Cl

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