6-Chloro-9-(3-C-methyl-b-D-ribofuranosyl)-9H-purine

Base Information

• Chemical Name: 6-Chloro-9-(3-C-methyl-b-D-ribofuranosyl)-9H-purine
• CAS No.: 849241-91-4
• Molecular Formula: C11H13ClN4O4
• Molecular Weight: 300.70
• DSSTox Substance ID: DTXSID50457383
• Wikidata: Q72455221
• Mol file: 849241-91-4.mol

Synonyms:6-Chloro-9-(3-C-methyl-b-D-ribofuranosyl)-9H-purine;849241-91-4;(2R,3S,4R,5R)-5-(6-chloropurin-9-yl)-2-(hydroxymethyl)-3-methyloxolane-3,4-diol;DTXSID50457383;AKOS016011660;A863864;(2R,3S,4R,5R)-5-(6-chloro-9H-purin-9-yl)-2-(hydroxymethyl)-3-methyloxolane-3,4-diol

Chemical Property of 6-Chloro-9-(3-C-methyl-b-D-ribofuranosyl)-9H-purine

Chemical Property:

• Boiling Point: 590.081 °C at 760 mmHg
• Flash Point: 310.67 °C
• PSA: 113.52000
• Density: 1.86 g/cm³
• LogP: -0.51870
• Storage Temp.: 2-8°C
• XLogP3: -0.4
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 2
• Exact Mass: 300.0625326
• Heavy Atom Count: 20
• Complexity: 378

Purity/Quality:

97% ^*data from raw suppliers

6-Chloro-9-(3-C-methyl-b-D-ribofuranosyl)-9H-purine 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1(C(OC(C1O)N2C=NC3=C2N=CN=C3Cl)CO)O
• Isomeric SMILES: C[C@]1([C@H](O[C@H]([C@@H]1O)N2C=NC3=C2N=CN=C3Cl)CO)O