9-(5-phenoxycarbothioyloxypentyl)-3H-purine-6-thione

Base Information

• Chemical Name: 9-(5-phenoxycarbothioyloxypentyl)-3H-purine-6-thione
• CAS No.: 7292-59-3
• Molecular Formula: C17H18 N4 O2 S2
• Molecular Weight: 374.4804
• NSC Number: 159718
• DSSTox Substance ID: DTXSID80400887

Synonyms:NSC159718;7292-59-3;DTXSID80400887;NSC-159718

Chemical Property of 9-(5-phenoxycarbothioyloxypentyl)-3H-purine-6-thione

Chemical Property:

• Vapor Pressure: 9.13E-14mmHg at 25°C
• Boiling Point: 587.1°Cat760mmHg
• Flash Point: 308.9°C
• Density: 1.35g/cm³
• XLogP3: 3.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 9
• Exact Mass: 374.08711818
• Heavy Atom Count: 25
• Complexity: 497

Purity/Quality:

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)OC(=S)OCCCCCN2C=NC3=C2NC=NC3=S

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