(6-methyl-3-(methylthio)-5-oxo-1,2,4-triazin-4(5H)-yl)methyl benzoate structure

(6-methyl-3-(methylthio)-5-oxo-1,2,4-triazin-4(5H)-yl)methyl benzoate

(6-methyl-3-methylsulfanyl-5-oxo-1,2,4-triazin-4-yl)methyl benzoate

Also Known As: SR-01000021142-1|(6-methyl-3-(methylthio)-5-oxo-1,2,4-triazin-4(5H)-yl)methyl benzoate|F2527-0031|(6-methyl-3-methylsulfanyl-5-oxo-1,2,4-triazin-4-yl)methyl benzoate|[6-methyl-3-(methylsulfanyl)-5-oxo-4,5-dihydro-1,2,4-triazin-4-yl]methyl benzoate

CAS: 877642-60-9
Molecular Formula C13H13N3O3S
Molecular Weight 291.06775 g/mol
LogP 1.48312
Topological Polar Surface Area 74.08 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 6
Rotatable Bonds 4
Exact Mass 291.06775
Monoisotopic Mass 291.06775
Heavy Atoms 20
Complexity 670.30676

Chemical Identifiers

CAS Number 877642-60-9
SMILES CC1=NN=C(N(C1=O)COC(=O)C2=CC=CC=C2)SC

Product Overview

(6-methyl-3-(methylthio)-5-oxo-1,2,4-triazin-4(5H)-yl)methyl benzoate (CAS 877642-60-9), with molecular formula C13H13N3O3S and molecular weight 291.06775 g/mol. IUPAC: (6-methyl-3-methylsulfanyl-5-oxo-1,2,4-triazin-4-yl)methyl benzoate.

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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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