AC1Q2KBS
3-[(3,4-dichlorophenyl)methylsulfanyl]-5-(4-methylphenyl)-4-prop-2-enyl-1,2,4-triazole
Also Known As: 4-allyl-3-((3,4-dichlorobenzyl)thio)-5-(p-tolyl)-4H-1,2,4-triazole|3-[(3,4-dichlorophenyl)methylsulfanyl]-5-(4-methylphenyl)-4-prop-2-enyl-1,2,4-triazole|3-[(3,4-dichlorophenyl)methylthio]-5-(4-methylphenyl)-4-prop-2-enyl-1,2,4-tria zole|3-[(3,4-dichlorobenzyl)sulfanyl]-5-(4-methylphenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazole|3-{[(3,4-dichlorophenyl)methyl]sulfanyl}-5-(4-methylphenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazole
CAS: 849005-77-2
| Molecular Formula | C19H17Cl2N3S |
|---|---|
| Molecular Weight | 389.05203 g/mol |
| LogP | 6.03862 |
| Topological Polar Surface Area | 30.71 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 389.05203 |
| Monoisotopic Mass | 389.05203 |
| Heavy Atoms | 25 |
| Complexity | 888.1849 |
Chemical Identifiers
| CAS Number | 849005-77-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2=NN=C(N2CC=C)SCC3=CC(=C(C=C3)Cl)Cl |
Product Overview
AC1Q2KBS (CAS 849005-77-2), with molecular formula C19H17Cl2N3S and molecular weight 389.05203 g/mol. IUPAC: 3-[(3,4-dichlorophenyl)methylsulfanyl]-5-(4-methylphenyl)-4-prop-2-enyl-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.
View MSDS →
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