Tebuconazole (CAS 80443-41-0) — formula C16H22ClN3O, molecular weight 307.82.
| CAS Number | 80443-41-0 |
|---|---|
| Molecular Formula | C16H22ClN3O |
| Molecular Weight | 307.82 |
| Melting Point | 105 °C |
| LogP | log Kow = 3.7 |
Tebuconazole is a chemical compound with CAS registry number 80443-41-0 and molecular formula C16H22ClN3O (molecular weight 307.82).
CAS number: 80443-41-0
Its molecular formula C16H22ClN3O comprises 16 C, 22 H, 1 Cl, 3 N, 1 O atoms.
Also known as: Tebuconazole · 戊唑醇
The CAS registry number of Tebuconazole is 80443-41-0.
Molecular formula C16H22ClN3O, molecular weight 307.82.
It is also registered under: Tebuconazole, 戊唑醇.
Independent reference data for Tebuconazole (CAS 80443-41-0), compiled from public chemistry databases.
| CAS Registry Number | 80443-41-0 |
|---|---|
| PubChem CID | 86102 |
| Molecular formula | C16H22ClN3O |
| IUPAC name | 1-(4-chlorophenyl)-4,4-dimethyl-3-(1,2,4-triazol-1-ylmethyl)pentan-3-ol |
| UNII (FDA) | 401ATW8TRW |
| Molecular Weight | 307.82 |
|---|---|
| XLogP3 | 3.7 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 6 |
| Exact Mass | 307.1451400 |
| Monoisotopic Mass | 307.1451400 |
| Topological Polar Surface Area | 50.9 |
| Heavy Atom Count | 21 |
| Melting Point | 105 °C |
|---|---|
| Solubility | In water, 36 mg/L at pH 5-9, 20 °C |
| Vapor Pressure | 0.00000001 [mmHg] |
| Vapor Pressure | 1.7X10-6 Pa (1.3X10-8 mm Hg) at 20 °C |
| LogP | log Kow = 3.7 |
| LogP | 3.7 |
| Collision Cross Section | 183.95 Ų [M+Cl]- |
| Collision Cross Section | 186.61 Ų [M+HCOO]- |
| Collision Cross Section | 166.8 Ų [M+H]+ |
Tebuconazole; 107534-96-3; Fenetrazole; Ethyltrianol; Etiltrianol; Folicur; Elite; Terbuconazole; Terbutrazole; Raxil; Preventol A 8; LYNX; HWG 1608; DTXSID9032113; 401ATW8TRW; SILVACURE
| Reported hazard statements | H302, H400, H410, H361 (69.9%), H411 (30.3%), H350, H360, H371 |
|---|
H302: Harmful if swallowed [Warning Acute toxicity, oral]
H361d ***: Suspected of damaging the unborn child [Warning Reproductive toxicity]
Tebuconazole · CAS 80443-41-0 · C16H22ClN3O. UNII 401ATW8TRW. Melting Point: 105 °C; Solubility: In water, 36 mg/L at pH 5-9, 20 °C; Vapor Pressure: 0.00000001 [mmHg].
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 戊唑醇