[R-(R*,S*)]-3,7-dihydro-7-[2-[(2-hydroxy-1-methyl-2-phenylethyl)amino]ethyl]-1,3-dimethyl-1H-purine-2,6-dione monohydrochloride (CAS 3039-97-2) — formula C18H24ClN5O3, molecular weight 393.9; category organic chemicals.
| CAS Number | 3039-97-2 |
|---|---|
| Molecular Formula | C18H24ClN5O3 |
| Molecular Weight | 393.9 |
| Category | Organic Chemicals |
[R-(R*,S*)]-3,7-dihydro-7-[2-[(2-hydroxy-1-methyl-2-phenylethyl)amino]ethyl]-1,3-dimethyl-1H-purine-2,6-dione monohydrochloride is a carbon-based organic compound with CAS registry number 3039-97-2 and molecular formula C18H24ClN5O3 (molecular weight 393.9), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 3039-97-2
Its molecular formula C18H24ClN5O3 comprises 18 C, 24 H, 1 Cl, 5 N, 3 O atoms.
Also known as: [R-(R*,S*)]-3,7-dihydro-7-[2-[(2-hydroxy-1-methyl-2-phenylethyl)amino]ethyl]-1,3-dimethyl-1H-purine-2,6-dione monohydrochloride · 化合物 Cafedrine HCl
Category: organic chemicals
The CAS registry number of [R-(R*,S*)]-3,7-dihydro-7-[2-[(2-hydroxy-1-methyl-2-phenylethyl)amino]ethyl]-1,3-dimethyl-1H-purine-2,6-dione monohydrochloride is 3039-97-2.
Molecular formula C18H24ClN5O3, molecular weight 393.9.
It is also registered under: [R-(R*,S*)]-3,7-dihydro-7-[2-[(2-hydroxy-1-methyl-2-phenylethyl)amino]ethyl]-1,3-dimethyl-1H-purine-2,6-dione monohydrochloride, 化合物 Cafedrine HCl.
Category: Organic Chemicals.
Independent reference data for [R-(R*,S*)]-3,7-dihydro-7-[2-[(2-hydroxy-1-methyl-2-phenylethyl)amino]ethyl]-1,3-dimethyl-1H-purine-2,6-dione monohydrochloride (CAS 3039-97-2), compiled from public chemistry databases.
| CAS 号 | 3039-97-2 |
|---|---|
| PubChem CID | 5492688 |
| 分子式 | C18H24ClN5O3 |
| IUPAC 名称 | 7-[2-[[(1R,2S)-1-hydroxy-1-phenylpropan-2-yl]amino]ethyl]-1,3-dimethylpurine-2,6-dione;hydrochloride |
| UNII（FDA） | L0N3M64B9R |
| Molecular Weight | 393.9 |
|---|---|
| Hydrogen Bond Donor Count | 3 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 6 |
| Exact Mass | 393.1567673 |
| Monoisotopic Mass | 393.1567673 |
| Topological Polar Surface Area | 90.7 |
| Heavy Atom Count | 27 |
Cafedrine hydrochloride; Cafedrine HCl; 3039-97-2; L0N3M64B9R; 7-(2-(beta-Hydroxy-alpha-methylphenethylamino)ethyl)theophylline hydrochloride; RefChem:122655; norephendrinetheophylline mono-hydrochloride, (R-(R*,S*))-; 221-243-0; Akrinor; L-Net; Cafedrin hydrochlorid; EINECS 221-243-0; UNII-L0N3M64B9R; Theophyllino-aethyl-nor-ephedrin-hydrochlorid [German]; Norephedrine, N-(2-(7-theophyllinyl)ethyl)-, hydrochloride; Theophyllino-aethyl-nor-ephedrin-hydrochlorid
| 已通报的危害声明 | H302 (100%), H332 (100%) |
|---|
化合物 Cafedrine HCl · CAS 3039-97-2 · C18H24ClN5O3. UNII L0N3M64B9R.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 化合物 Cafedrine HCl