3-Hydroxyguanine

Base Information

• Chemical Name: 3-Hydroxyguanine
• CAS No.: 30345-22-3
• Molecular Formula: C₅H₅N₅O₂
• Molecular Weight: 167.127
• NSC Number: 145425
• UNII: G97838TM5Z
• DSSTox Substance ID: DTXSID60952692
• Wikidata: Q27278954
• ChEMBL ID: CHEMBL1741561
• Mol file: 30345-22-3.mol

Synonyms:3-Hydroxyguanine;2-amino-3-hydroxy-7H-purin-6-one;NSC145425;6H-Purin-6-one, 2-amino-3,7-dihydro-3-hydroxy-;18905-29-8;30345-22-3;G97838TM5Z;NSC-145425;Guanine 3-N-oxide;Guanine, 3-oxide;Guanol;guanine-3-oxide;NCIStruc1_000260;NCIStruc2_000148;GUANINE, 3-HYDROXY-;6H-Purin-6-one, 3-oxide;SCHEMBL864452;UNII-G97838TM5Z;CHEMBL1741561;SCHEMBL12168371;SCHEMBL16494562;DTXSID60952692;2-amino-7H-35-purine-3,6-diol;NCGC00014384;NCI145425;NCGC00014384-02;NCGC00097492-01;NCI60_000982;2-Imino-2,9-dihydro-3H-purine-3,6-diol;Q27278954;6H-PURIN-6-ONE, 2-AMINO-3,9-DIHYDRO-3-HYDROXY-

Chemical Property of 3-Hydroxyguanine

Chemical Property:

• XLogP3: -1.4
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 0
• Exact Mass: 167.04432442
• Heavy Atom Count: 12
• Complexity: 252

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=NC2=C(N1)C(=O)N=C(N2O)N