AC1M0D6H
3-(4-methylphenyl)-5-[(E)-3-phenylprop-2-enyl]sulfanyl-1,2,4-triazol-4-amine
Also Known As: 3-(cinnamylthio)-5-(p-tolyl)-4H-1,2,4-triazol-4-amine|3-(4-methylphenyl)-5-[(E)-3-phenylprop-2-enyl]sulfanyl-1,2,4-triazol-4-amine|3-(4-methylphenyl)-5-{[(2E)-3-phenylprop-2-en-1-yl]sulfanyl}-4H-1,2,4-triazol-4-amine
CAS: 577990-63-7
| Molecular Formula | C18H18N4S |
|---|---|
| Molecular Weight | 322.1252 g/mol |
| LogP | 3.77282 |
| Topological Polar Surface Area | 56.73 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 322.1252 |
| Monoisotopic Mass | 322.1252 |
| Heavy Atoms | 23 |
| Complexity | 791.64874 |
Chemical Identifiers
| CAS Number | 577990-63-7 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2=NN=C(N2N)SC/C=C/C3=CC=CC=C3 |
Product Overview
AC1M0D6H (CAS 577990-63-7), with molecular formula C18H18N4S and molecular weight 322.1252 g/mol. IUPAC: 3-(4-methylphenyl)-5-[(E)-3-phenylprop-2-enyl]sulfanyl-1,2,4-triazol-4-amine.
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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