Caffeine, 8-((2-aminoethyl)thio)-, hydrochloride

Base Information

• Chemical Name: Caffeine, 8-((2-aminoethyl)thio)-, hydrochloride
• CAS No.: 6493-25-0
• Molecular Formula: C10H15 N5 O2 S . Cl H
• Molecular Weight: 305.7843

Synonyms:CAFFEINE, 8-((2-AMINOETHYL)THIO)-, HYDROCHLORIDE;1H-Purine-2,6-dione, 3,7-dihydro-8-((2-aminoethyl)thio)-1,3,7-trimethyl-, hydrochloride;6493-25-0;C10H15N4O2.ClH;C10-H15-N4-O2.Cl-H;LS-48567

Chemical Property of Caffeine, 8-((2-aminoethyl)thio)-, hydrochloride

Chemical Property:

• Vapor Pressure: 1.01E-10mmHg at 25°C
• Boiling Point: 508.8°Cat760mmHg
• Flash Point: 261.5°C
• Density: g/cm³
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 3
• Exact Mass: 305.0713236
• Heavy Atom Count: 19
• Complexity: 473

Purity/Quality:

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C[NH+]1C2=C(N=C1SCCN)N(C(=O)N(C2=O)C)C.[Cl-]

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