Xanthinol (CAS 2530-97-4) — formula C13H21N5O4, molecular weight 311.34; category organic chemicals.
| CAS Number | 2530-97-4 |
|---|---|
| Molecular Formula | C13H21N5O4 |
| Molecular Weight | 311.34 |
| Melting Point | 179-180 ºC |
| Boiling Point | 589.3 |
| LogP | -1.8 |
| Category | Organic Chemicals |
Xanthinol is a carbon-based organic compound with CAS registry number 2530-97-4 and molecular formula C13H21N5O4 (molecular weight 311.34), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 2530-97-4
Its molecular formula C13H21N5O4 comprises 13 C, 21 H, 5 N, 4 O atoms.
Also known as: Xanthinol · 占替诺
Category: organic chemicals
The CAS registry number of Xanthinol is 2530-97-4.
Molecular formula C13H21N5O4, molecular weight 311.34.
It is also registered under: Xanthinol, 占替诺.
Category: Organic Chemicals.
Independent reference data for Xanthinol (CAS 2530-97-4), compiled from public chemistry databases.
| CAS 号 | 2530-97-4 |
|---|---|
| PubChem CID | 9913 |
| 分子式 | C13H21N5O4 |
| IUPAC 名称 | 7-[2-hydroxy-3-[2-hydroxyethyl(methyl)amino]propyl]-1,3-dimethylpurine-2,6-dione |
| UNII（FDA） | TN1B5910V2 |
| Molecular Weight | 311.34 |
|---|---|
| XLogP3 | -1.8 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 6 |
| Exact Mass | 311.15935417 |
| Monoisotopic Mass | 311.15935417 |
| Topological Polar Surface Area | 102 |
| Heavy Atom Count | 22 |
| Boiling Point | 589.3 |
|---|---|
| Melting Point | 179-180 ºC |
| Solubility | <1 mg/mL |
Xanthinol; 2530-97-4; xantinol; UNII-TN1B5910V2; TN1B5910V2; 7-(2-Hydroxy-3-(N-(2-hydroxyethyl)-N-methylamino)propyl)theophylline; DTXSID1048255; Theophylline, 7-(2-hydroxy-3-(N-(2-hydroxyethyl)-N-methylamino)propyl)-; 7-{2-hydroxy-3-[(2-hydroxyethyl)(methyl)amino]propyl}-1,3-dimethyl-2,3,6,7-tetrahydro-1H-purine-2,6-dione; 7-(2-hydroxy-3-((2-hydroxyethyl)(methyl)amino)propyl)-1,3-dimethyl-2,3,6,7-tetrahydro-1H-purine-2,6-dione; RefChem:195113; DTXCID6028230; DSFGXPJYDCSWTA-UHFFFAOYSA-N; 7-[2-hydroxy-3-[2-hydroxyethyl(methyl)amino]propyl]-1,3-dimethylpurine-2,6-dione; 7-{2-hydroxy-3-[(2-hydroxyethyl)(methyl)amino]propyl}-1,3-dimethyl-3,7-dihydro-1h-purine-2,6-dione; Jupal
占替诺 · CAS 2530-97-4 · C13H21N5O4. UNII TN1B5910V2. Boiling Point: 589.3; Melting Point: 179-180 ºC; Solubility: <1 mg/mL.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 占替诺