8-[(2-Chlorophenyl)amino]-3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione (CAS 5429-34-5) — formula C13H12ClN5O2, molecular weight 305.72; category organic chemicals.
| CAS Number | 5429-34-5 |
|---|---|
| Molecular Formula | C13H12ClN5O2 |
| Molecular Weight | 305.72 |
| LogP | 2.1 |
| Category | Organic Chemicals |
8-[(2-Chlorophenyl)amino]-3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione is a carbon-based organic compound with CAS registry number 5429-34-5 and molecular formula C13H12ClN5O2 (molecular weight 305.72), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 5429-34-5
Its molecular formula C13H12ClN5O2 comprises 13 C, 12 H, 1 Cl, 5 N, 2 O atoms.
Also known as: 8-[(2-Chlorophenyl)amino]-3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione · 8-[(2-氯苯基)氨基]-3,7-二氢-1,3-二甲基-1H-嘌呤-2,6-二酮
Category: organic chemicals
The CAS registry number of 8-[(2-Chlorophenyl)amino]-3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione is 5429-34-5.
Molecular formula C13H12ClN5O2, molecular weight 305.72.
It is also registered under: 8-[(2-Chlorophenyl)amino]-3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione, 8-[(2-氯苯基)氨基]-3,7-二氢-1,3-二甲基-1H-嘌呤-2,6-二酮.
Category: Organic Chemicals.
Independent reference data for 8-[(2-Chlorophenyl)amino]-3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione (CAS 5429-34-5), compiled from public chemistry databases.
| CAS 号 | 5429-34-5 |
|---|---|
| PubChem CID | 95026 |
| 分子式 | C13H12ClN5O2 |
| IUPAC 名称 | 8-(2-chloroanilino)-1,3-dimethyl-7H-purine-2,6-dione |
| UNII（FDA） | AR39JZ6KK5 |
| Molecular Weight | 305.72 |
|---|---|
| XLogP3 | 2.1 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 2 |
| Exact Mass | 305.0679523 |
| Monoisotopic Mass | 305.0679523 |
| Topological Polar Surface Area | 81.3 |
| Heavy Atom Count | 21 |
Theophylline, 8-(o-chloroanilino)-; 8-(o-Chloroanilino)theophylline; 8-(o-Chlorophenylamino)theophylline; NSC 14125; DTXSID60202644; 1H-Purine-2,6-dione, 8-((2-chlorophenyl)amino)-3,7-dihydro-1,3-dimethyl-; RefChem:384464; DTXCID90125135; 1H-Purine-2,6-dione, 8-((2-chlorophenyl)amino)-3,7-dihydro-1,3-dimethyl-(9CI); 5429-34-5; NSC-14125; NSC14125; AR39JZ6KK5; 8-(2-Chloroanilino)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione; 1H-Purine-2, 8-[(2-chlorophenyl)amino]-3,7-dihydro-1,3-dimethyl-; 8-[(2-Chlorophenyl)amino]-3,9-dihydro-1,3-dimethyl-1H-purine-2,6-dione
8-[(2-氯苯基)氨基]-3,7-二氢-1,3-二甲基-1H-嘌呤-2,6-二酮 · CAS 5429-34-5 · C13H12ClN5O2. UNII AR39JZ6KK5.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.