51679-43-7
N-(2-METHYL-5-(TRIFLUOROMETHYLSULFONYL)PHENYL)ANTHRANILIC ACID
NameN-(2-METHYL-5-(TRIFLUOROMETHYLSULFONYL)PHENYL)ANTHRANILIC ACID
1Identification
【Name】
N-(2-METHYL-5-(TRIFLUOROMETHYLSULFONYL)PHENYL)ANTHRANILIC ACID
【CAS】
【MDL】
MFCD01675239
【English Synonyms】
【Formula】
C15 H12 F3 N O4 S
【MolWeight】
359.323
【Inchi】
InChI=1S/C15H12F3NO4S/c1-9-6-7-10(24(22,23)15(16,17)18)8-13(9)19-12-5-3-2-4-11(12)14(20)21/h2-8,19H,1H3,(H,20,21)
【InChIKey】
InChIKey=XXPMKUAPCCFHDO-UHFFFAOYSA-N
【SMILES】
Cc1ccc(cc1Nc2ccccc2C(=O)O)S(=O)(=O)C(F)(F)F
【MOL File】
N-(2-METHYL-5-(TRIFL….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:5
XLogP3:5.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
N-(2-METHYL-5-(TRIFLUOROMETHYLSULFONYL)PHENYL)ANTHRANILIC ACID.cml