1-methyl-3-propylxanthine (CAS 72117-78-3) — formula C9H12N4O2, molecular weight 208.22; category organic chemicals.
| CAS Number | 72117-78-3 |
|---|---|
| Molecular Formula | C9H12N4O2 |
| Molecular Weight | 208.22 |
| LogP | 0.9 |
| Category | Organic Chemicals |
1-methyl-3-propylxanthine is a carbon-based organic compound with CAS registry number 72117-78-3 and molecular formula C9H12N4O2 (molecular weight 208.22), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 72117-78-3
Its molecular formula C9H12N4O2 comprises 9 C, 12 H, 4 N, 2 O atoms.
Also known as: 1-methyl-3-propylxanthine · 1-甲基-3-丙基黄嘌呤
Category: organic chemicals
The CAS registry number of 1-methyl-3-propylxanthine is 72117-78-3.
Molecular formula C9H12N4O2, molecular weight 208.22.
It is also registered under: 1-methyl-3-propylxanthine, 1-甲基-3-丙基黄嘌呤.
Category: Organic Chemicals.
Independent reference data for 1-methyl-3-propylxanthine (CAS 72117-78-3), compiled from public chemistry databases.
| CAS 号 | 72117-78-3 |
|---|---|
| PubChem CID | 174907 |
| 分子式 | C9H12N4O2 |
| IUPAC 名称 | 3-methyl-1-propyl-7H-purine-2,6-dione |
| UNII（FDA） | 8YM307PRAS |
| Molecular Weight | 208.22 |
|---|---|
| XLogP3 | 0.9 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 2 |
| Exact Mass | 208.09602564 |
| Monoisotopic Mass | 208.09602564 |
| Topological Polar Surface Area | 69.3 |
| Heavy Atom Count | 15 |
72117-78-3; 1-MPX; 8YM307PRAS; RefChem:907676; 1-Methyl-3-propylxanthine; 3-methyl-1-propylxanthine; CHEMBL112369; Athyltheophyllin; UNII-8YM307PRAS; SCHEMBL7460178; SCHEMBL27483075; DTXSID20992837; UEGOAAXVUJWIHJ-UHFFFAOYSA-N; BDBM50001489; 3-Methyl-1-propyl-3,7-dihydro-purine-2,6-dione; 3-Methyl-1-propyl-3,9-dihydro-1H-purine-2,6-dione
1-甲基-3-丙基黄嘌呤 · CAS 72117-78-3 · C9H12N4O2. UNII 8YM307PRAS.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 1-甲基-3-丙基黄嘌呤