Product Name: Trifloxysulfuron (CAS NO.145099-21-4)
Molecular Formula: C14H14F3N5O6S
Molecular Weight: 437.35g/mol
Mol File: 145099-21-4.mol
Melting Point: 195 ºC
Density: 1.531 g/cm3
Surface Tension: 57.145 dyne/cm
XLogP3-AA: 2.2
H-Bond Donor: 2
H-Bond Acceptor: 12
Structure Descriptors of Trifloxysulfuron (CAS NO.145099-21-4):
IUPAC Name: 1-(4,6-dimethoxypyrimidin-2-yl)-3-[3-(2,2,2-trifluoroethoxy)pyridin-2-yl]sulfonylurea
Canonical SMILES: COC1=CC(=NC(=N1)NC(=O)NS(=O)(=O)C2=C(C=CC=N2)OCC(F)(F)F)OC
InChI: InChI=1S/C14H14F3N5O6S/c1-26-9-6-10(27-2)20-12(19-9)21-13(23)22-29(24,25)11-8(4-3-5-18-11)28-7-14(15,16)17/h3-6H,7H2,1-2H3,(H2,19,20,21,22,23)
InChIKey: AIMMSOZBPYFASU-UHFFFAOYSA-N
Trifloxysulfuron , its CAS NO. is 145099-21-4, the synonyms are 1-(4,6-dimethoxypyrimidin-2-yl)-3-[3-(2,2,2-trifluoroethoxy)-2-pyridylsulfonyl]urea ; N-[[(4,6-dimethoxy-2-pyrimidinyl)amino]carbonyl]-3-(2,2,2-trifluoroethoxy)-2-pyridinesulfonamide .
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