Toltrazuril-d3

Base Information

• Chemical Name: Toltrazuril-d3
• CAS No.: 1353867-75-0
• Molecular Formula: C18H14F3N3O4S
• Molecular Weight: 428.4
• European Community (EC) Number: 809-043-7
• DSSTox Substance ID: DTXSID401016408
• Mol file: 1353867-75-0.mol

Synonyms:Toltrazuril-d3;1353867-75-0;1-[3-methyl-4-[4-(trifluoromethylsulfanyl)phenoxy]phenyl]-3-(trideuteriomethyl)-1,3,5-triazinane-2,4,6-trione;OCINXEZVIIVXFU-BMSJAHLVSA-N;DTXSID401016408;Toltrazuril-(N-methyl-d3), VETRANAL(TM), analytical standard

Chemical Property of Toltrazuril-d3

Chemical Property:

• XLogP3: 4.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 4
• Exact Mass: 428.08454183
• Heavy Atom Count: 29
• Complexity: 655

Purity/Quality:

NLT 98% ^*data from raw suppliers

Toltrazuril-d3 ^*data from reagent suppliers

Safty Information:

• Hazard Codes: N
• Statements: 50/53
• Safety Statements: 60-61

MSDS Files:

Useful:

• Canonical SMILES: CC1=C(C=CC(=C1)N2C(=O)NC(=O)N(C2=O)C)OC3=CC=C(C=C3)SC(F)(F)F
• Isomeric SMILES: [2H]C([2H])([2H])N1C(=O)NC(=O)N(C1=O)C2=CC(=C(C=C2)OC3=CC=C(C=C3)SC(F)(F)F)C

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