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Paclobutrazol · CAS 76738-62-0 · C15H20ClN3O. UNII 6PLV42R3ZA. Ionization Efficiency: 3.79; Ionization Efficiency: 2.7; Ionization Efficiency: MeCN (80%).
| CAS Registry Number | 76738-62-0 |
|---|---|
| PubChem CID | 73671 |
| Molecular formula | C15H20ClN3O |
| IUPAC name | (2S,3S)-1-(4-chlorophenyl)-4,4-dimethyl-2-(1,2,4-triazol-1-yl)pentan-3-ol |
| UNII (FDA) | 6PLV42R3ZA |
| Molecular Weight | 293.79 |
|---|---|
| XLogP3 | 3.2 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 5 |
| Exact Mass | 293.1294900 |
| Monoisotopic Mass | 293.1294900 |
| Topological Polar Surface Area | 50.9 |
| Heavy Atom Count | 20 |
| Formal Charge | 0 |
| Ionization Efficiency | 3.79 |
|---|---|
| Ionization Efficiency | 2.7 |
| Ionization Efficiency | MeCN (80%) |
| Ionization Efficiency | DOI:10.1038/s41598-020-62573-z |
| Collision Cross Section | 170 Ų [M+H]+ |
| Collision Cross Section | 177.82 Ų [M+Cl]- |
| Collision Cross Section | 180.28 Ų [M+HCOO]- |
| Reported hazard statements | H302, H319, H332, H400, H410, H228 (50%), H312 (47.4%), H315 (13.8%) |
|---|
H302: Harmful if swallowed [Warning Acute toxicity, oral]
H319: Causes serious eye irritation [Warning Serious eye damage/eye irritation]
Paclobutrazol; Bonzi; 76738-62-0; Friazole; Clipper 50WP; Trimmit; Cultar; Parlay; 6PLV42R3ZA; (2S,3S)-1-(4-chlorophenyl)-4,4-dimethyl-2-(1H-1,2,4-triazol-1-yl)pentan-3-ol; DTXSID2024242; 1H-1,2,4-Triazole-1-ethanol, beta-((4-chlorophenyl)methyl)-alpha-(1,1-dimethylethyl)-, (alphaR,betaR)-rel-; DTXCID50196503; RefChem:858277; CHEBI:73162; 616-379-6
CAS 76738-62-0; molecular formula C15H20ClN3O; molecular weight — g/mol.
Paclobutrazol, Bonzi, 76738-62-0, Friazole, Clipper 50WP, Trimmit.
Hazard statements reported: H302, H319, H332, H400, H410.
Ionization Efficiency: 3.79; Ionization Efficiency: 2.7; Ionization Efficiency: MeCN (80%); Ionization Efficiency: DOI:10.1038/s41598-020-62573-z.
Facts on this page are taken from PubChem (US National Library of Medicine) and Wikidata. Grade-specific data — assay, moisture, particle size, packaging, shelf life — is issued per batch on the COA and is not published here.