Paraxanthine
- IUPAC name
- 1,7-dimethyl-3H-purine-2,6-dione
- Molecular formula
- C7H8N4O2
- Molecular weight
- 180.16 g/mol
- Exact mass
- 180.06472551 Da
- XLogP3
- -0.2
- Topological polar surface area
- 67.2 Ų
- Hydrogen-bond donors
- 1
- Hydrogen-bond acceptors
- 3
- Covalent units
- 1
- Defined stereocentres
- 0
Also known as
16 more reported names
External database identifiers
- ChEBI:CHEBI:25858
- ChEMBL:CHEMBL1158
- EPA DTXSID:DTXSID2052281
- PubMed:31132250
- PubMed:22941669
- PubMed:22751681
- PubMed:22701600
- PubMed:22563483
- PubMed:22554278
- PubMed:22483397
- PubMed:22423996
- PubMed:22420682
- PubMed:22348079
- PubMed:22235437
- PubMed:22189672
Retrieved from NIH PubChem on 2026-08-31 by checksum-valid CAS matching. Chemical properties do not replace the regulatory decision on this page.