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Benzoylcyclohexane-1,3-diones

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  1. 2-(2-Chloro-4-(methylsulfonyl)-3-((2,2,2-trifluoroethoxy)methyl)benzoyl)cyclohexane-1,3-dione
      Grade & Purity: 
    • ≥95%
    Cas Number: 335104-84-2        Compound CID:  11556911
    Formula:  C17H16ClF3O6S        Molecular Weight: 440.8
    IUPAC Name:  2-[2-chloro-4-methylsulfonyl-3-(2,2,2-trifluoroethoxymethyl)benzoyl]cyclohexane-1,3-dione
    SMILES:  CS(=O)(=O)C1=C(C(=C(C=C1)C(=O)C2C(=O)CCCC2=O)Cl)COCC(F)(F)F
    InChIKey: IUQAXCIUEPFPSF-UHFFFAOYSA-N
    InChI:  InChI=1S/C17H16ClF3O6S/c1-28(25,26)13-6-5-9(15(18)10(13)7-27-8-17(19,20)21)16(24)14-11(22)3-2-4-12(14)23/h5-6,14H,2-4,7-8H2,1H3
  2. Sulcotrione
    Cas Number: 99105-77-8        Compound CID:  91760
    Formula:  C14H13ClO5S        Molecular Weight: 328.77
    IUPAC Name:  2-(2-chloro-4-methylsulfonylbenzoyl)cyclohexane-1,3-dione
    SMILES:  CS(=O)(=O)C1=CC(=C(C=C1)C(=O)C2C(=O)CCCC2=O)Cl
    InChIKey: PQTBTIFWAXVEPB-UHFFFAOYSA-N
    InChI:  InChI=1S/C14H13ClO5S/c1-21(19,20)8-5-6-9(10(15)7-8)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3
    Synonyms: Thiazolium, 5-(2-hydroxyethyl)-4-methyl-3-(phenylmethyl)-, chloride | 2-(2-Chloro-4-(methylsulfonyl)benzoyl)cyclohexa...
  3. Nitisinone
    Cas Number: 104206-65-7
    Formula:  C14H10F3NO5        Molecular Weight: 329.23
    IUPAC Name:  2-[2-nitro-4-(trifluoromethyl)benzoyl]cyclohexane-1,3-dione
    SMILES:  C1CC(=O)C(C(=O)C1)C(=O)C2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-]
    InChIKey: OUBCNLGXQFSTLU-UHFFFAOYSA-N
    InChI:  InChI=1S/C14H10F3NO5/c15-14(16,17)7-4-5-8(9(6-7)18(22)23)13(21)12-10(19)2-1-3-11(12)20/h4-6,12H,1-3H2
    Synonyms: FT-0672739 | NITISINONE [MART.] | 2-[2-Nitro-4-(trifluoromethyl)benzoyl]-1,3-cyclohexanedione | 2-[2-nitro-4-(trifluo...
  4. Mesotrione
    Cas Number: 104206-82-8
    Formula:  C14H13NO7S        Molecular Weight: 339.32
    IUPAC Name:  2-(4-methylsulfonyl-2-nitrobenzoyl)cyclohexane-1,3-dione
    SMILES:  CS(=O)(=O)C1=CC(=C(C=C1)C(=O)C2C(=O)CCCC2=O)[N+](=O)[O-]
    InChIKey: KPUREKXXPHOJQT-UHFFFAOYSA-N
    InChI:  InChI=1S/C14H13NO7S/c1-23(21,22)8-5-6-9(10(7-8)15(19)20)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3
    Synonyms: Callisto herbicide | NCGC00163843-04 | Q409390 | 2-Nitro-4-(methylsulfonyl)benzoicacid | 48TR68G21T | 1,3-Cyclohexane...
  5. Nitisinone
    Cas Number: 104206-65-7
    Formula:  C14H10F3NO5        Molecular Weight: 329.23
    IUPAC Name:  2-[2-nitro-4-(trifluoromethyl)benzoyl]cyclohexane-1,3-dione
    SMILES:  C1CC(=O)C(C(=O)C1)C(=O)C2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-]
    InChIKey: OUBCNLGXQFSTLU-UHFFFAOYSA-N
    InChI:  InChI=1S/C14H10F3NO5/c15-14(16,17)7-4-5-8(9(6-7)18(22)23)13(21)12-10(19)2-1-3-11(12)20/h4-6,12H,1-3H2
    Synonyms: FT-0672739 | NITISINONE [MART.] | 2-[2-Nitro-4-(trifluoromethyl)benzoyl]-1,3-cyclohexanedione | 2-[2-nitro-4-(trifluo...
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