1-(ETHYL-3-CARBOXYPROPYL)-3,7-DIMETHYLXANTHINE (CAS 83636-88-8) — formula C13H18N4O4, molecular weight 294.31; category organic chemicals.
| CAS Number | 83636-88-8 |
|---|---|
| Molecular Formula | C13H18N4O4 |
| Molecular Weight | 294.31 |
| LogP | 0.5 |
| Category | Organic Chemicals |
1-(ETHYL-3-CARBOXYPROPYL)-3,7-DIMETHYLXANTHINE is a carbon-based organic compound with CAS registry number 83636-88-8 and molecular formula C13H18N4O4 (molecular weight 294.31), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 83636-88-8
Its molecular formula C13H18N4O4 comprises 13 C, 18 H, 4 N, 4 O atoms.
Also known as: 1-(ETHYL-3-CARBOXYPROPYL)-3,7-DIMETHYLXANTHINE · 4-(3,7-二甲基-2,6-二氧代-2,3,6,7-四氢-1H-嘌呤-1-基)己酸
Category: organic chemicals
The CAS registry number of 1-(ETHYL-3-CARBOXYPROPYL)-3,7-DIMETHYLXANTHINE is 83636-88-8.
Molecular formula C13H18N4O4, molecular weight 294.31.
It is also registered under: 1-(ETHYL-3-CARBOXYPROPYL)-3,7-DIMETHYLXANTHINE, 4-(3,7-二甲基-2,6-二氧代-2,3,6,7-四氢-1H-嘌呤-1-基)己酸.
Category: Organic Chemicals.
Independent reference data for 1-(ETHYL-3-CARBOXYPROPYL)-3,7-DIMETHYLXANTHINE (CAS 83636-88-8), compiled from public chemistry databases.
| CAS 号 | 83636-88-8 |
|---|---|
| PubChem CID | 9904193 |
| 分子式 | C13H18N4O4 |
| IUPAC 名称 | ethyl 4-(3,7-dimethyl-2,6-dioxopurin-1-yl)butanoate |
| Molecular Weight | 294.31 |
|---|---|
| XLogP3 | 0.5 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 6 |
| Exact Mass | 294.13280507 |
| Monoisotopic Mass | 294.13280507 |
| Topological Polar Surface Area | 84.7 |
| Heavy Atom Count | 21 |
1-(Ethyl-3-carboxypropyl)-3,7-dimethylxanthine; CHEMBL170479; ethyl 4-(3,7-dimethyl-2,6-dioxopurin-1-yl)butanoate; 2,3,6,7-Tetrahydro-3,7-dimethyl-2,6-dioxo-1H-purine-1-butanoic Acid Ethyl Ester; SCHEMBL5424162; DTXSID80432643; BDBM50048933; FE23116; ethyl 4-(3,7-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-1-yl)butanoate; 4-(3,7-Dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-purin-1-yl)-butyric acid ethyl ester
4-(3,7-二甲基-2,6-二氧代-2,3,6,7-四氢-1H-嘌呤-1-基)己酸 · CAS 83636-88-8 · C13H18N4O4.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.