1,9-Dimethylxanthine
CAS Registry Number®
33073-01-7
No image available.
CAS Name
1,9-DimethylxanthineMolecular Formula
C7H8N4O2Molecular Mass
180.16Cite this Page
1,9-Dimethylxanthine. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=33073-01-7 (retrieved ) (CAS RN: 33073-01-7). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Melting Point (1)
350 °C (decomp)
Source(s)
Other Names and Identifiers
InChI
InChI=1S/C7H8N4O2/c1-10-3-8-4-5(10)9-7(13)11(2)6(4)12/h3H,1-2H3,(H,9,13)
InChIKey
InChIKey=XKZALMBJTMJPFU-UHFFFAOYSA-N
SMILES
O=C1C2=C(NC(=O)N1C)N(C)C=N2
Canonical SMILES
O=C1NC2=C(N=CN2C)C(=O)N1C
Other Names for this Substance
- 1H-Purine-2,6-dione, 3,9-dihydro-1,9-dimethyl-
- Xanthine, 1,9-dimethyl-
- 3,9-Dihydro-1,9-dimethyl-1H-purine-2,6-dione
- 1,9-Dimethylxanthine
- 1,9-Dimethyl-1H-purine-2,6(3H,9H)-dione
