7-[3-[[2-(3,5-Dihydroxyphenyl)-2-hydroxyethyl]amino]-2-hydroxypropyl]theophyline (CAS 62401-99-4) — formula C17H21N5O6, molecular weight 391.4; category organic chemicals.
| CAS Number | 62401-99-4 |
|---|---|
| Molecular Formula | C17H21N5O6 |
| Molecular Weight | 391.4 |
| LogP | -1.8 |
| Category | Organic Chemicals |
7-[3-[[2-(3,5-Dihydroxyphenyl)-2-hydroxyethyl]amino]-2-hydroxypropyl]theophyline is a carbon-based organic compound with CAS registry number 62401-99-4 and molecular formula C17H21N5O6 (molecular weight 391.4), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 62401-99-4
Its molecular formula C17H21N5O6 comprises 17 C, 21 H, 5 N, 6 O atoms.
Also known as: 7-[3-[[2-(3,5-Dihydroxyphenyl)-2-hydroxyethyl]amino]-2-hydroxypropyl]theophyline · 7-[3-[[2-(3,5-二羟基苯基)-2-羟乙基]氨基]-2-羟丙基]茶碱
Category: organic chemicals
The CAS registry number of 7-[3-[[2-(3,5-Dihydroxyphenyl)-2-hydroxyethyl]amino]-2-hydroxypropyl]theophyline is 62401-99-4.
Molecular formula C17H21N5O6, molecular weight 391.4.
It is also registered under: 7-[3-[[2-(3,5-Dihydroxyphenyl)-2-hydroxyethyl]amino]-2-hydroxypropyl]theophyline, 7-[3-[[2-(3,5-二羟基苯基)-2-羟乙基]氨基]-2-羟丙基]茶碱.
Category: Organic Chemicals.
Independent reference data for 7-[3-[[2-(3,5-Dihydroxyphenyl)-2-hydroxyethyl]amino]-2-hydroxypropyl]theophyline (CAS 62401-99-4), compiled from public chemistry databases.
| CAS 号 | 62401-99-4 |
|---|---|
| PubChem CID | 3046584 |
| 分子式 | C17H21N5O6 |
| IUPAC 名称 | 7-[3-[[2-(3,5-dihydroxyphenyl)-2-hydroxyethyl]amino]-2-hydroxypropyl]-3-methylpurine-2,6-dione |
| Molecular Weight | 391.4 |
|---|---|
| XLogP3 | -1.8 |
| Hydrogen Bond Donor Count | 6 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 7 |
| Exact Mass | 391.14918341 |
| Monoisotopic Mass | 391.14918341 |
| Topological Polar Surface Area | 160 |
| Heavy Atom Count | 28 |
D 4933; BRN 1189557; DTXSID30977978; 7-(3-((2-(3,5-Dihydroxyphenyl)-2-hydroxyethyl)amino)-2-hydroxypropyl)theophylline; Theophylline, 7-(3-((2-(3,5-dihydroxyphenyl)-2-hydroxyethyl)amino)-2-hydroxypropyl)-
7-[3-[[2-(3,5-二羟基苯基)-2-羟乙基]氨基]-2-羟丙基]茶碱 · CAS 62401-99-4 · C17H21N5O6.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.