Zilpaterol (CAS 117827-79-9) — formula C14H19N3O2, molecular weight 261.32; category organic chemicals.
| CAS Number | 117827-79-9 |
|---|---|
| Molecular Formula | C14H19N3O2 |
| Molecular Weight | 261.32 |
| LogP | 0.5 |
| Category | Organic Chemicals |
Zilpaterol is a carbon-based organic compound with CAS registry number 117827-79-9 and molecular formula C14H19N3O2 (molecular weight 261.32), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 117827-79-9
Its molecular formula C14H19N3O2 comprises 14 C, 19 H, 3 N, 2 O atoms.
Also known as: Zilpaterol · 齐帕特罗
Category: organic chemicals
The CAS registry number of Zilpaterol is 117827-79-9.
Molecular formula C14H19N3O2, molecular weight 261.32.
It is also registered under: Zilpaterol, 齐帕特罗.
Category: Organic Chemicals.
Independent reference data for Zilpaterol (CAS 117827-79-9), compiled from public chemistry databases.
| CAS Registry Number | 117827-79-9 |
|---|---|
| PubChem CID | 3086576 |
| Molecular formula | C14H19N3O2 |
| IUPAC name | (9R,10R)-9-hydroxy-10-(propan-2-ylamino)-1,3-diazatricyclo[6.4.1.04,13]trideca-4,6,8(13)-trien-2-one |
| UNII (FDA) | S384A1Y12J |
| Molecular Weight | 261.32 |
|---|---|
| XLogP3 | 0.5 |
| Hydrogen Bond Donor Count | 3 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 2 |
| Exact Mass | 261.147726857 |
| Monoisotopic Mass | 261.147726857 |
| Topological Polar Surface Area | 64.6 |
| Heavy Atom Count | 19 |
| Collision Cross Section | 182.75 Ų [M+Na]+ |
|---|---|
| Collision Cross Section | 162.36 Ų [M+H]+ |
| Collision Cross Section | 165.86 Ų [M-H]- |
Zilpaterol; 119520-05-7; RU-42173; S384A1Y12J; RU 42173; RU 42 173; DTXSID50904261; zilpaterolum; RefChem:56664; DTXCID401333410; (9R,10R)-9-hydroxy-10-((propan-2-yl)amino)-1,3-diazatricyclo(6.4.1.0^(4,13))trideca-4,6,8(13)-trien-2-one; Zilpaterol [INN]; UNII-S384A1Y12J; 117827-79-9; (9R,10R)-9-hydroxy-10-(propan-2-ylamino)-1,3-diazatricyclo[6.4.1.04,13]trideca-4,6,8(13)-trien-2-one; (+/-)-trans-4,5,6,7-Tetrahydro-7-hydroxy-6-(isopropylamino)imidazo[4,5,1-jk][1]benzazepin-2(1H)-one
| Reported hazard statements | H301 (100%), H331 (100%), H372 (100%), H302, H332 (100%) |
|---|
H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]
H331 (100%): Toxic if inhaled [Danger Acute toxicity, inhalation]
Zilpaterol · CAS 117827-79-9 · C14H19N3O2. UNII S384A1Y12J. Collision Cross Section: 182.75 Ų [M+Na]+; Collision Cross Section: 162.36 Ų [M+H]+; Collision Cross Section: 165.86 Ų [M-H]-.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 齐帕特罗