1,3-Propanediol, 2-[(2,6-diamino-9H-purin-9-yl)methoxy]-

Base Information

• Chemical Name: 1,3-Propanediol, 2-[(2,6-diamino-9H-purin-9-yl)methoxy]-
• CAS No.: 86629-59-6
• Molecular Formula: C9H14N6O3
• Molecular Weight: 254.249
• DSSTox Substance ID: DTXSID70388387
• Nikkaji Number: J1.089.754H
• Wikidata: Q82183326
• ChEMBL ID: CHEMBL281821
• Mol file: 86629-59-6.mol

Synonyms:1,3-Propanediol, 2-[(2,6-diamino-9H-purin-9-yl)methoxy]-;2-[(2,6-diaminopurin-9-yl)methoxy]propane-1,3-diol;86629-59-6;CHEMBL281821;SCHEMBL9123481;DTXSID70388387;VRMNUBZQJCWRKA-UHFFFAOYSA-N;2,6-diamino-9-(1,3-dihydroxy-2-propoxymethyl)purine;2,6-diamino-9-(1,3-di-hydroxy-2-propoxymethyl)purine;2-[(2,6-Diamino-9H-purine-9-yl)methoxy]-1,3-propanediol

Chemical Property of 1,3-Propanediol, 2-[(2,6-diamino-9H-purin-9-yl)methoxy]-

Chemical Property:

• XLogP3: -2.1
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 5
• Exact Mass: 254.11273833
• Heavy Atom Count: 18
• Complexity: 267

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=NC2=C(N=C(N=C2N1COC(CO)CO)N)N