Tralopyril (CAS 122454-29-9) — formula C12H5BrClF3N2, molecular weight 349.53; category organic chemicals.
| CAS Number | 122454-29-9 |
|---|---|
| Molecular Formula | C12H5BrClF3N2 |
| Molecular Weight | 349.53 |
| LogP | 4.3 |
| Category | Organic Chemicals |
Tralopyril is a carbon-based organic compound with CAS registry number 122454-29-9 and molecular formula C12H5BrClF3N2 (molecular weight 349.53), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 122454-29-9
Its molecular formula C12H5BrClF3N2 comprises 12 C, 5 H, 1 Br, 1 Cl, 3 F, 2 N atoms.
Also known as: Tralopyril · 曲吡利
Category: organic chemicals
The CAS registry number of Tralopyril is 122454-29-9.
Molecular formula C12H5BrClF3N2, molecular weight 349.53.
It is also registered under: Tralopyril, 曲吡利.
Category: Organic Chemicals.
Independent reference data for Tralopyril (CAS 122454-29-9), compiled from public chemistry databases.
| CAS Registry Number | 122454-29-9 |
|---|---|
| PubChem CID | 183559 |
| Molecular formula | C12H5BrClF3N2 |
| IUPAC name | 4-bromo-2-(4-chlorophenyl)-5-(trifluoromethyl)-1H-pyrrole-3-carbonitrile |
| UNII (FDA) | MEC6MCY7QB |
| Molecular Weight | 349.53 |
|---|---|
| XLogP3 | 4.3 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 1 |
| Exact Mass | 347.92767 |
| Monoisotopic Mass | 347.92767 |
| Topological Polar Surface Area | 39.6 |
| Heavy Atom Count | 19 |
Tralopyril; 122454-29-9; 4-bromo-2-(4-chlorophenyl)-5-(trifluoromethyl)-1H-pyrrole-3-carbonitrile; Econea; 1H-Pyrrole-3-carbonitrile, 4-bromo-2-(4-chlorophenyl)-5-(trifluoromethyl)-; DTXSID6041503; MEC6MCY7QB; 4-Bromo-2-(4-chlorophenyl)-5-(trifluoromethyl)pyrrole-3-carbonitrile; AC-303268; DTXCID4021503; CHEBI:141497; 4-bromo-2-(p-chlorophenyl)-5-(trifluoromethyl)pyrrole-3-carbonitrile; CL-303268; RefChem:190553; 602-784-5; Tralopyril [ISO]
| GHS notification summary | 5.7% (5 / 87) |
|---|
| GHS notification summary | 5.7% (5 / 87) |
|---|---|
| Reported hazard statements | H300 (21.8%), H301 (27.6%), H311 (23%), H330 (21.8%), H331 (27.6%), H372 (21.8%), H373 (21.8%), H400 (94.3%) |
This chemical does not meet GHS hazard criteria for 5.7% (5 of 87) of reports.
H300 (21.8%): Fatal if swallowed [Danger Acute toxicity, oral]
Tralopyril · CAS 122454-29-9 · C12H5BrClF3N2. UNII MEC6MCY7QB.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 曲吡利