9-(2,3,4-Tri-O-benzylpentopyranosyl)-9H-purine-6-thiol

Base Information

• Chemical Name: 9-(2,3,4-Tri-O-benzylpentopyranosyl)-9H-purine-6-thiol
• CAS No.: 26848-09-9
• Molecular Formula: C31H30 N4 O4 S
• Molecular Weight: 554.6593
• NSC Number: 122799,122798
• DSSTox Substance ID: DTXSID10949638

Synonyms:26848-08-8;NSC122798;DTXSID10949638;NSC122799;NSC-122798;NSC-122799;9-(2,3,4-Tri-O-benzylpentopyranosyl)-9H-purine-6-thiol;26848-09-9

Chemical Property of 9-(2,3,4-Tri-O-benzylpentopyranosyl)-9H-purine-6-thiol

Chemical Property:

• Vapor Pressure: 7.43E-23mmHg at 25°C
• Boiling Point: 757.8°C at 760 mmHg
• Flash Point: 412.1°C
• Density: 1.32g/cm³
• XLogP3: 4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 10
• Exact Mass: 554.19877662
• Heavy Atom Count: 40
• Complexity: 830

Purity/Quality:

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1C(C(C(C(O1)N2C=NC3=C2NC=NC3=S)OCC4=CC=CC=C4)OCC5=CC=CC=C5)OCC6=CC=CC=C6

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