Molecular properties
- Formula
- C6H6N4O3
- Molar mass
- 182.14 g·mol−1
- Exact mass
- 182.0440 Da
- 6
- PubChem CID
- 11804
Molecule record
3-methyl-7,9-dihydropurine-2,6,8-trione
C6H6N4O3
182.14 g/mol
Loading structure
Functional groups
Alkane / alkyl carbon
Aromatic ring
Physical properties
No source-backed physical properties are curated for this molecule yet.
Common names and synonyms
- 210-101-3
- 3-METHYLURIC ACID
- 3-Methyl-2,6,8-trioxopurine
- 3-Methyl-7,9-dihydro-3H-purine-2,6,8-trione
- 3-Methyluric acid; LC-tDDA; CE10
- 3-methyl-2,3,6,7,8,9-hexahydro-1H-purine-2,6,8-trione
- 3-methylurate
- 4,9-Dihydro-3-methyl-1H-purine-2,6,8(3H)-trione
Show all 24 synonyms
- 605-99-2
- 7,9-dihydro-3-methyl-1h-purine-2,6,8(3h)-trione
- AKOS006271765
- AS-87551
- CHEBI:165839
- CHEMBL791
- DB-081566
- DTXCID70131734
- DTXSID50209243
- EINECS 210-101-3
- N3-Methyluric Acid
- ODCYDGXXCHTFIR-UHFFFAOYSA-N
- RefChem:1068334
- S87L3X5TJ9
- SCHEMBL133905
- Uric acid, 3-methyl-
Structure identifiers
- Canonical SMILES
- Cn1c(=O)[nH]c(=O)c2[nH]c(=O)[nH]c21
- Isomeric SMILES
- CN1C2=C(C(=O)NC1=O)NC(=O)N2
- InChI
- InChI=1S/C6H6N4O3/c1-10-3-2(7-5(12)8-3)4(11)9-6(10)13/h1H3,(H2,7,8,12)(H,9,11,13)
- InChIKey
- ODCYDGXXCHTFIR-UHFFFAOYSA-N
- PubChem CID
- 11804
Spectroscopy
Tabs appear only for spectra stored with clear provenance.
No redistributable or simulated spectroscopy record is attached yet.
Simulated NMR
On-demand educational prediction for 3-methyl-7,9-dihydropurine-2,6,8-trione; not experimental data.
Simulated EI mass spectrum
On-demand educational fragmentation for 3-methyl-7,9-dihydropurine-2,6,8-trione; not experimental data.
Sources
Molecule identity
Retrieved 8/20/2026. Reuse status is summarized by the badge; open the source for full details.