7-Benzyl-8-(2-n-butylaminoethyl)aminotheophylline hydrochloride

Base Information

• Chemical Name: 7-Benzyl-8-(2-n-butylaminoethyl)aminotheophylline hydrochloride
• CAS No.: 130187-60-9
• Molecular Formula: C20H28 N6 O2 . Cl H
• Molecular Weight: 0
• DSSTox Substance ID: DTXSID60156395
• Mol file: 130187-60-9.mol

Synonyms:130187-60-9;7-Benzyl-8-(2-n-butylaminoethyl)aminotheophylline hydrochloride;7-Benzyl-8-(2-n-butylaminoethyl)aminotheophylline HCl;1H-Purine-2,6-dione, 3,7-dihydro-8-((2-(butylamino)ethyl)amino)-1,3-dimethyl-7-(phenylmethyl)-, monohydrochloride;7-BENZYL-8-(2-BUTYLAMINOETHYLAMINO)-1,3-DIMETHYL-PURINE-2,6-DIONE HYDR OCHLORIDE;7-benzyl-8-[2-(butylamino)ethylamino]-1,3-dimethylpurine-2,6-dione;hydrochloride;DTXSID60156395;HQGQMQAPAZRMQW-UHFFFAOYSA-N;C20-H28-N6-O2.Cl-H;LS-126614

Chemical Property of 7-Benzyl-8-(2-n-butylaminoethyl)aminotheophylline hydrochloride

Chemical Property:

• Vapor Pressure: 8.05E-14mmHg at 25°C
• Boiling Point: 588.3°Cat760mmHg
• Flash Point: 309.6°C
• PSA: 89.11000
• Density: g/cm³
• LogP: 1.89840
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 9
• Exact Mass: 420.2040519
• Heavy Atom Count: 29
• Complexity: 539

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCNCCNC1=NC2=C(N1CC3=CC=CC=C3)C(=O)N(C(=O)N2C)C.Cl