Theophylline, 8-(chloromethyl)-7-ethyl-
8-(chloromethyl)-7-ethyl-1,3-dimethylpurine-2,6-dione
Also Known As: 8- -7-ethyltheophyline|Theophylline, 8-(chloromethyl)-7-ethyl-|8-(Chloromethyl)-7-ethyltheophyline|8-(chloromethyl)-7-ethyl-1,3-dimethylpurine-2,6-dione|8-(Chloromethyl)-7-ethyl-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione #|8-(Chloromethyl)-7-ethyl-3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione|8-(chloromethyl)-7-ethyl-1,3-dimethyl-2,3,6,7-tetrahydro-1H-purine-2,6-dione
| Molecular Formula | C10H13ClN4O2 |
|---|---|
| Molecular Weight | 256.0727 g/mol |
| LogP | 0.3 |
| Topological Polar Surface Area | 58.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 256.0727 |
| Monoisotopic Mass | 256.0727 |
| Heavy Atoms | 17 |
| Complexity | 351.0 |
Chemical Identifiers
| CAS Number | 27042-88-2 |
|---|---|
| SMILES | CCN1C(=NC2=C1C(=O)N(C(=O)N2C)C)CCl |
| InChIKey | CJWHFABMVOMXAG-UHFFFAOYSA-N |
Product Overview
Theophylline, 8-(chloromethyl)-7-ethyl- (CAS 27042-88-2), with molecular formula C10H13ClN4O2 and molecular weight 256.0727 g/mol. IUPAC: 8-(chloromethyl)-7-ethyl-1,3-dimethylpurine-2,6-dione.
Theophylline, 8-(chloromethyl)-7-ethyl- is a custom synthesis product. We offer services from milligram to kilogram scale.
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