1H-1,2,4-Triazole-1-propanenitrile, alpha-butyl-alpha-phenyl-
2-phenyl-2-(1,2,4-triazol-1-ylmethyl)hexanenitrile
Also Known As: 1H-1,2,4-Triazole-1-propanenitrile, alpha-butyl-alpha-phenyl-|2-phenyl-2-(1,2,4-triazol-1-ylmethyl)hexanenitrile|2-phenyl-2-[1,2,4]triazol-1-ylmethyl-hexanenitrile|2-Phenyl-2-(1h-1,2,4-triazol-1-ylmethyl)hexanenitrile|3-(5-butyl-3-phenyl-1,2,4-triazol-1-yl)propanenitrile|2-Phenyl-2-[(1H-1,2,4-triazol-1-yl)methyl]hexanenitrile|alpha-butyl-alpha-phenyl-1H-1,2,4-triazole-1propanenitrile|alpha-butyl-alpha-phenyl-1H-1,2,4-triazole-1-propanenitrile|1H-1,2,4-Triazole-1-propanenitrile, .alpha.-butyl-.alpha.-phenyl-
| Molecular Formula | C15H18N4 |
|---|---|
| Molecular Weight | 254.15315 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 54.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 254.15315 |
| Monoisotopic Mass | 254.15315 |
| Heavy Atoms | 19 |
| Complexity | 315.0 |
Chemical Identifiers
| CAS Number | 69820-63-9 |
|---|---|
| SMILES | CCCCC(CN1C=NC=N1)(C#N)C2=CC=CC=C2 |
| InChIKey | WSBXOYCTBXULGP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1H-1,2,4-Triazole-1-propanenitrile, alpha-butyl-alpha-phenyl- (CAS 69820-63-9), with molecular formula C15H18N4 and molecular weight 254.15315 g/mol. IUPAC: 2-phenyl-2-(1,2,4-triazol-1-ylmethyl)hexanenitrile.
1H-1,2,4-Triazole-1-propanenitrile, alpha-butyl-alpha-phenyl- is a custom synthesis product. We offer services from milligram to kilogram scale.
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