Xanthine
- IUPAC name
- 3,7-dihydropurine-2,6-dione
- Molecular formula
- C5H4N4O2
- Molecular weight
- 152.11 g/mol
- Exact mass
- 152.03342538 Da
- XLogP3
- -0.7
- Topological polar surface area
- 86.9 Ų
- Hydrogen-bond donors
- 3
- Hydrogen-bond acceptors
- 3
- Covalent units
- 1
- Defined stereocentres
- 0
Also known as
16 more reported names
External database identifiers
- ChEBI:CHEBI:17712
- ChEBI:CHEBI:48517
- ChEMBL:CHEMBL1424
- EPA DTXSID:DTXSID4035120
- PubMed:39172838
- PubMed:34044073
- PubMed:26374991
- PubMed:25450233
- PubMed:23112391
- PubMed:23105872
- PubMed:23105690
- PubMed:23105658
- PubMed:23105569
- PubMed:23105515
- PubMed:23105492
- PubMed:23105489
Retrieved from NIH PubChem on 2026-08-31 by checksum-valid CAS matching. Chemical properties do not replace the regulatory decision on this page.