8-Ethyl-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione (CAS 5770-28-5) — formula C9H12N4O2, molecular weight 208.22; category organic chemicals.
| CAS Number | 5770-28-5 |
|---|---|
| Molecular Formula | C9H12N4O2 |
| Molecular Weight | 208.22 |
| LogP | 0.8 |
| Category | Organic Chemicals |
8-Ethyl-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione is a carbon-based organic compound with CAS registry number 5770-28-5 and molecular formula C9H12N4O2 (molecular weight 208.22), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 5770-28-5
Its molecular formula C9H12N4O2 comprises 9 C, 12 H, 4 N, 2 O atoms.
Also known as: 8-Ethyl-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione · 8-乙基-1,3-二甲基-1H-嘌呤-2,6(3H,7H)-二酮
Category: organic chemicals
The CAS registry number of 8-Ethyl-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione is 5770-28-5.
Molecular formula C9H12N4O2, molecular weight 208.22.
It is also registered under: 8-Ethyl-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione, 8-乙基-1,3-二甲基-1H-嘌呤-2,6(3H,7H)-二酮.
Category: Organic Chemicals.
Independent reference data for 8-Ethyl-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione (CAS 5770-28-5), compiled from public chemistry databases.
| CAS 号 | 5770-28-5 |
|---|---|
| PubChem CID | 79838 |
| 分子式 | C9H12N4O2 |
| IUPAC 名称 | 8-ethyl-1,3-dimethyl-7H-purine-2,6-dione |
| UNII（FDA） | HMS1579G06 |
| Molecular Weight | 208.22 |
|---|---|
| XLogP3 | 0.8 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 1 |
| Exact Mass | 208.09602564 |
| Monoisotopic Mass | 208.09602564 |
| Topological Polar Surface Area | 69.3 |
| Heavy Atom Count | 15 |
8-Ethyltheophylline; 5770-28-5; DTXSID10206410; RefChem:1074696; DTXCID10128901; 8-ethyl-3,9-dihydro-1,3-dimethyl-1H-Purine-2,6-dione; 8-ethyl-1,3-dimethyl-2,3,6,7-tetrahydro-1H-purine-2,6-dione; Theophylline, 8-ethyl-; 8-Ethyl-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione; 8-ethyl-1,3-dimethyl-7H-purine-2,6-dione; Xanthine, 1,3-dimethyl-8-ethyl-; NSC 14294; 1,3-dimethyl-8-ethylxanthine; 8-ethyl-1,3-dimethyl-3,7-dihydro-1h-purine-2,6-dione; NSC14294; 1H-Purine-2,6-dione, 8-ethyl-3,7-dihydro-1,3-dimethyl-
8-乙基-1,3-二甲基-1H-嘌呤-2,6(3H,7H)-二酮 · CAS 5770-28-5 · C9H12N4O2. UNII HMS1579G06.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.