8,8'-Ethylmethyleneditheophylline

Base Information

• Chemical Name: 8,8'-Ethylmethyleneditheophylline
• CAS No.: 73908-74-4
• Molecular Formula: C17H20N8O4
• Molecular Weight: 400.3919
• DSSTox Substance ID: DTXSID40224480
• Nikkaji Number: J130.198E
• Wikidata: Q83103074
• Mol file: 73908-74-4.mol

Synonyms:8,8'-Ethylmethyleneditheophylline;Theophylline, 8,8'-ethylmethylenedi-;73908-74-4;alpha-Ethyl-8,8'-ditheophyllinemethane;DTXSID40224480;C17H20N8O4;C17-H20-N8-O4;LS-149553;8,8'-Propylidenebis[1,3-dimethyl-1H-purine-2,6(3H,7H)-dione];1H-Purine-2,6-dione, 8,8'-propylidenebis[3,7-dihydro-1,3-dimethyl-

Chemical Property of 8,8'-Ethylmethyleneditheophylline

Chemical Property:

• Boiling Point: 776.4°Cat760mmHg
• Flash Point: 423.3°C
• PSA: 145.36000
• Density: 1.485g/cm³
• LogP: -1.22410
• XLogP3: 0
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 3
• Exact Mass: 400.16075115
• Heavy Atom Count: 29
• Complexity: 702

Purity/Quality:

99% ^*data from raw suppliers

8,8'-ETHYLMETHYLENE DITHEOPHYLLINE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC(C1=NC2=C(N1)C(=O)N(C(=O)N2C)C)C3=NC4=C(N3)C(=O)N(C(=O)N4C)C

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