AC1LPY8P
3-(4-nitrophenyl)-4-prop-2-enyl-5-[(2,4,6-trimethylphenyl)methylsulfanyl]-1,2,4-triazole
Also Known As: 3-(4-nitrophenyl)-4-prop-2-enyl-5-[(2,4,6-trimethylphenyl)methylsulfanyl]-1,2,4-triazole|3-(4-nitrophenyl)-4-(prop-2-en-1-yl)-5-[(2,4,6-trimethylbenzyl)sulfanyl]-4H-1,2,4-triazole
CAS: 693231-80-0
| Molecular Formula | C21H22N4O2S |
|---|---|
| Molecular Weight | 394.14636 g/mol |
| LogP | 5.25686 |
| Topological Polar Surface Area | 73.85 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 394.14636 |
| Monoisotopic Mass | 394.14636 |
| Heavy Atoms | 28 |
| Complexity | 1002.38 |
Chemical Identifiers
| CAS Number | 693231-80-0 |
|---|---|
| SMILES | CC1=CC(=C(C(=C1)C)CSC2=NN=C(N2CC=C)C3=CC=C(C=C3)[N+](=O)[O-])C |
Product Overview
AC1LPY8P (CAS 693231-80-0), with molecular formula C21H22N4O2S and molecular weight 394.14636 g/mol. IUPAC: 3-(4-nitrophenyl)-4-prop-2-enyl-5-[(2,4,6-trimethylphenyl)methylsulfanyl]-1,2,4-triazole.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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