chempirical

Triflusulfuron-methyl

C17H19F3N6O6SCAS 126535-15-7492.43 g/mol

Open in Covalent MOL file
OOSOONHONHNOFFFNNN
Alkyl halideEsterEtherSulfonamideTertiary amine

Properties

Molecular formula
C17H19F3N6O6S
Molar mass
492.43 g/mol
Exact mass
492.1039 Da
logP
1.50Crippen estimate
Polar surface area
156.2 Ų
H-bond donors / acceptors
2 / 10
Rotatable bonds
7

Identifiers

CAS number
126535-15-7
SMILES
COC(=O)c1cccc(C)c1S(=O)(=O)NC(O)=Nc1nc(OCC(F)(F)F)nc(N(C)C)n1
InChIKey
IMEVJVISCHQJRM-UHFFFAOYSA-N
InChI
InChI=1S/C17H19F3N6O6S/c1-9-6-5-7-10(12(27)31-4)11(9)33(29,30)25-15(28)22-13-21-14(26(2)3)24-16(23-13)32-8-17(18,19)20/h5-7H,8H2,1-4H3,(H2,21,22,23,24,25,28)

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

11 names
  • Benzoic acid, 2-[[[[[4-(dimethylamino)-6-(2,2,2-trifluoroethoxy)-1,3,5-triazin-2-yl]amino]carbonyl]amino]sulfonyl]-3-methyl-, methyl ester
  • DPX 66037
  • Safari
  • Upbeet
  • Safari (herbicide)
  • Caribou (herbicide)
  • Caribou
  • Kari-maks fluid
  • Kari-max fluid
  • Kari-max
  • Kari-maks

Work with Triflusulfuron-methyl

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Sulfometuron methyl74222-97-246 % similar Primisulfuron-methyl86209-51-043 % similar Trifloxysulfuron145099-21-442 % similar Bensulfuron-methyl83055-99-640 % similar Mesosulfuron-methyl208465-21-837 % similar Oxasulfuron144651-06-936 % similar Chlorimuron-ethyl90982-32-436 % similar Nicosulfuron111991-09-435 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

PubChem CAS Common Chemistry NIST WebBook