1-[3-[3,5-bis(trifluoromethyl)phenyl]-2-propynyl]-4-(tert-butyl)piperidinium chloride (CAS 81613-60-7) — formula C20H24ClF6N, molecular weight 427.9; category organic chemicals.
| CAS Number | 81613-60-7 |
|---|---|
| Molecular Formula | C20H24ClF6N |
| Molecular Weight | 427.9 |
| Category | Organic Chemicals |
1-[3-[3,5-bis(trifluoromethyl)phenyl]-2-propynyl]-4-(tert-butyl)piperidinium chloride is a carbon-based organic compound with CAS registry number 81613-60-7 and molecular formula C20H24ClF6N (molecular weight 427.9), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 81613-60-7
Its molecular formula C20H24ClF6N comprises 20 C, 24 H, 1 Cl, 6 F, 1 N atoms.
Also known as: 1-[3-[3,5-bis(trifluoromethyl)phenyl]-2-propynyl]-4-(tert-butyl)piperidinium chloride · 1-[3-[3,5-双(三氟甲基)苯基]-2-丙炔基]-4-(叔丁基)哌啶氯化物
Category: organic chemicals
The CAS registry number of 1-[3-[3,5-bis(trifluoromethyl)phenyl]-2-propynyl]-4-(tert-butyl)piperidinium chloride is 81613-60-7.
Molecular formula C20H24ClF6N, molecular weight 427.9.
It is also registered under: 1-[3-[3,5-bis(trifluoromethyl)phenyl]-2-propynyl]-4-(tert-butyl)piperidinium chloride, 1-[3-[3,5-双(三氟甲基)苯基]-2-丙炔基]-4-(叔丁基)哌啶氯化物.
Category: Organic Chemicals.
Independent reference data for 1-[3-[3,5-bis(trifluoromethyl)phenyl]-2-propynyl]-4-(tert-butyl)piperidinium chloride (CAS 81613-60-7), compiled from public chemistry databases.
| CAS 号 | 81613-60-7 |
|---|---|
| PubChem CID | 198597 |
| 分子式 | C20H24ClF6N |
| IUPAC 名称 | 1-[3-[3,5-bis(trifluoromethyl)phenyl]prop-2-ynyl]-4-tert-butylpiperidine;hydrochloride |
| Molecular Weight | 427.9 |
|---|---|
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 3 |
| Exact Mass | 427.1501464 |
| Monoisotopic Mass | 427.1501464 |
| Topological Polar Surface Area | 3.2 |
| Heavy Atom Count | 28 |
81613-60-7; Flupropadine Hydrochloride; Piperidine, 1-(3-(3,5-bis(trifluoromethyl)phenyl)-2-propynyl)-4-(1,1-dimethylethyl)-, hydrochloride; DTXSID90231225; RefChem:1085461; DTXCID90153716; 279-786-4; 1-[3-[3,5-bis(trifluoromethyl)phenyl]prop-2-ynyl]-4-tert-butylpiperidine;hydrochloride; EINECS 279-786-4; SCHEMBL434587; PIPERIDINE, 1-(3-(3,5-BIS(TRIFLUORO-METHYL)PHENYL)-2-PROPYNYL)-4-(1,1-DIMETHYLETHYL)-, HYDROCHLORIDE; 1-(3,5-bistrifluoromethylphenyl)-3-(4-tert-butylpiperidino)prop-1-yne hydrochloride; 1-{3-[3,5-Bis(trifluoromethyl)phenyl]prop-2-yn-1-yl}-4-tert-butylpiperidine--hydrogen chloride (1/1)
1-[3-[3,5-双(三氟甲基)苯基]-2-丙炔基]-4-(叔丁基)哌啶氯化物 · CAS 81613-60-7 · C20H24ClF6N.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.