8-(3-CARBOXYPROPYL)-1,3-DIMETHYLXANTHINE (CAS 5438-71-1) — formula C11H14N4O4, molecular weight 266.25; category organic chemicals.
| CAS Number | 5438-71-1 |
|---|---|
| Molecular Formula | C11H14N4O4 |
| Molecular Weight | 266.25 |
| LogP | 0.1 |
| Category | Organic Chemicals |
8-(3-CARBOXYPROPYL)-1,3-DIMETHYLXANTHINE is a carbon-based organic compound with CAS registry number 5438-71-1 and molecular formula C11H14N4O4 (molecular weight 266.25), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 5438-71-1
Its molecular formula C11H14N4O4 comprises 11 C, 14 H, 4 N, 4 O atoms.
Also known as: 8-(3-CARBOXYPROPYL)-1,3-DIMETHYLXANTHINE · 茶碱-8-丁酸
Category: organic chemicals
The CAS registry number of 8-(3-CARBOXYPROPYL)-1,3-DIMETHYLXANTHINE is 5438-71-1.
Molecular formula C11H14N4O4, molecular weight 266.25.
It is also registered under: 8-(3-CARBOXYPROPYL)-1,3-DIMETHYLXANTHINE, 茶碱-8-丁酸.
Category: Organic Chemicals.
Independent reference data for 8-(3-CARBOXYPROPYL)-1,3-DIMETHYLXANTHINE (CAS 5438-71-1), compiled from public chemistry databases.
| CAS 号 | 5438-71-1 |
|---|---|
| PubChem CID | 95036 |
| 分子式 | C11H14N4O4 |
| IUPAC 名称 | 4-(1,3-dimethyl-2,6-dioxo-7H-purin-8-yl)butanoic acid |
| UNII（FDA） | 1UR2VV86WO |
| Molecular Weight | 266.25 |
|---|---|
| XLogP3 | 0.1 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 4 |
| Exact Mass | 266.10150494 |
| Monoisotopic Mass | 266.10150494 |
| Topological Polar Surface Area | 107 |
| Heavy Atom Count | 19 |
Theophylline-8-butyric acid; 5438-71-1; 8-(3-Carboxypropyl)theophylline; 1UR2VV86WO; NSC-14374; 2,3,6,9-TETRAHYDRO-1,3-DIMETHYL-2,6-DIOXO-1H-PURINE-8-BUTANOIC ACID; RefChem:1059252; 8-Theophyllinebutyric acid; 4-(1,3-dimethyl-2,6-dioxo-7H-purin-8-yl)butanoic acid; 8-(3-Carboxypropyl)-1,3-dimethylxanthine; 1H-Purine-8-butanoic acid, 2,3,6,7-tetrahydro-1,3-dimethyl-2,6-dioxo-; CHEMBL115261; NSC 14374; Theophylline-8-butanoic acid; UNII-1UR2VV86WO; Theophylline 8-Butyric Acid
茶碱-8-丁酸 · CAS 5438-71-1 · C11H14N4O4. UNII 1UR2VV86WO.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 茶碱-8-丁酸