1023311-08-1
4-isothiocyanato-N-(4-trifluoromethyl-phenyl)benzenesulfonamide
Name4-isothiocyanato-N-(4-trifluoromethyl-phenyl)benzenesulfonamide
1Identification
【Name】
4-isothiocyanato-N-(4-trifluoromethyl-phenyl)benzenesulfonamide
【CAS】
【MDL】
【English Synonyms】
【Formula】
C14H9F3N2O2S2
【MolWeight】
358.359
【Inchi】
InChI=1S/C14H9F3N2O2S2/c15-14(16,17)10-1-3-12(4-2-10)19-23(20,21)13-7-5-11(6-8-13)18-9-22/h1-8,19H
【InChIKey】
InChIKey=BCRVSEPVTZUQEL-UHFFFAOYSA-N
【SMILES】
N(=C=S)C1=CC=C(C=C1)S(=O)(=O)NC1=CC=C(C=C1)C(F)(F)F
【MOL File】
4-isothiocyanato-N-(….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:0
XLogP3:0.0
Bulk/Fine:
3Material Safety Data Sheet(MSDS)
4CML File
4-isothiocyanato-N-(4-trifluoromethyl-phenyl)benzenesulfonamide.cml