8-Ethyl-3,9-dihydro-1,3-dimethyl-1H-purine-2,6-dione
CAS Registry Number®
5770-28-5
CAS Name
8-Ethyl-3,9-dihydro-1,3-dimethyl-1H-purine-2,6-dioneMolecular Formula
C9H12N4O2Molecular Mass
208.22Cite this Page
8-Ethyl-3,9-dihydro-1,3-dimethyl-1H-purine-2,6-dione. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=5770-28-5 (retrieved ) (CAS RN: 5770-28-5). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Melting Point (1)
270 °C
Source(s)
Other Names and Identifiers
InChI
InChI=1S/C9H12N4O2/c1-4-5-10-6-7(11-5)12(2)9(15)13(3)8(6)14/h4H2,1-3H3,(H,10,11)
InChIKey
InChIKey=KTJSVELYMZTQJB-UHFFFAOYSA-N
SMILES
O=C1C2=C(N(C)C(=O)N1C)N=C(CC)N2
Canonical SMILES
O=C1C=2NC(=NC2N(C(=O)N1C)C)CC
Other Names for this Substance
- 1H-Purine-2,6-dione, 8-ethyl-3,9-dihydro-1,3-dimethyl-
- Theophylline, 8-ethyl-
- 1H-Purine-2,6-dione, 8-ethyl-3,7-dihydro-1,3-dimethyl-
- 8-Ethyl-3,9-dihydro-1,3-dimethyl-1H-purine-2,6-dione
- 8-Ethyltheophylline
