AG002Y7U

293754-55-9 | Benzenesulfonamide, N-(2,2,2-trifluoroethyl)-N-[4-[2,2,2-trifluoro-1-hydroxy-1-(trifluoromethyl)ethyl]phenyl]-

AG002Y7U

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CAS Number	293754-55-9
Catalog Number	AG002Y7U(AGN-PC-0JRCK2)
Chemical Name	Benzenesulfonamide, N-(2,2,2-trifluoroethyl)-N-[4-[2,2,2-trifluoro-1-hydroxy-1-(trifluoromethyl)ethyl]phenyl]-
IUPAC Name	N-[4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl]-N-(2,2,2-trifluoroethyl)benzenesulfonamide
InChI	InChI=1S/C17H12F9NO3S/c18-14(19,20)10-27(31(29,30)13-4-2-1-3-5-13)12-8-6-11(7-9-12)15(28,16(21,22)23)17(24,25)26/h1-9,28H,10H2
InChI Key	SGIWFELWJPNFDH-UHFFFAOYSA-N
MDL Number	MFCD03412028
Molecular Formula	C17H12F9NO3S
Molecular Weight	481.3327
SMILES	O=S(C1=CC=CC=C1)(N(CC(F)(F)F)C2=CC=C(C(C(F)(F)F)(O)C(F)(F)F)C=C2)=O
UNII	A07663A39I
Synonyms	N-(2,2,2-Trifluoroethyl)-N-(4-(2,2,2-trifluoro-1- hydroxy-1-trifluoromethylethyl)phenyl)benzenesulfonamide, N-(4-(1,1,1,3,3,3-hexafluoro-2-hydroxy-propan-2-yl)phenyl)-N-(2,2,2-trifluoroethyl)benzenesulfonamide, T 0901317, T 1371, T-0901317, T-1371, T0901317, T1371 cpd, TO-901317, TO901317, T0901317, 293754-55-9, T 0901317, TO-901317, TO901317, UNII-A07663A39I, T-0901317, N-[4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl]-N-(2,2,2-trifluoroethyl)benzenesulfonamide, CHEMBL62136, A07663A39I, Benzenesulfonamide, N-(2,2,2-trifluoroethyl)-N-[4-[2,2,2-trifluoro-1-hydroxy-1-(trifluoromethyl)ethyl]phenyl]-, N-(2,2,2-trifluoroethyl)-N-[4-[2,2,2-trifluoro-1-hydroxy-1-(trifluoromethyl)ethyl]phenyl]benzenesulfonamide, N-(2,2,2-TRIFLUOROETHYL)-N-{4-[2,2,2-TRIFLUORO-1-HYDROXY-1-(TRIFLUOROMETHYL)ETHYL]PHENYL}BENZENESULFONAMIDE, T-1317, N-(2,2,2-Trifluoroethyl)-N-[4-(2,2,2-trifluoro-1-hydroxy-1-trifluoromethylethyl)phenyl]sulfonamide, [3H]T0901317, SR-05000000453, 1pqc, N-(4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl)-N-(2,2,2-trifluoroethyl)benzenesulfonamide, 2o9i, 4nb6, TO 901317, AC1L9LDO, T 1317, MLS002554297, N-(4-(1,1,1,3,3,3-hexafluoro-2-hydroxy-propan-2-yl)phenyl)-N-(2,2,2-trifluoroethyl)benzenesulfonamide, SCHEMBL457231, C17H12F9NO3S, GTPL2755, DTXSID6040618, BDBM19993, CTK8E9178, KS-00001CSQ, HMS3268P10, HMS3649G14, HMS3652B22, HMS3677I08, ML125, BCP03658, EX-A1278, ZINC1550221, 2738AH, BN0745, MFCD03412028, s7076, AKOS017345034, API0009998, CS-5951, DB07080, SB19595, NCGC00159555-01, NCGC00159555-02, NCGC00159555-03, NCGC00159555-06, AK175740, HY-10626, SMR001456586, BCP0726000164, RT-015868, SW203816-2, C15630, J-017492, SR-05000000453-1, SR-05000000453-2, SR-05000000453-5, T-901317, BRD-K23383398-001-01-6, T0901317, >=98%, Benzenesulfonamide,N-(2,2,2-trifluoroethyl)-N-[4-[2,2,2-trifluoro-1-hydroxy-1-(trifluoromethyl)ethyl]phenyl]-, D0B5FC, T1371 cpd, SGIWFELWJPNFDH-UHFFFAOYSA-N, CID447912, A2249, A12652, T 1371, T-1371, C423915, N-(2,2,2-Trifluoroethyl)-N-(4-(2,2,2-trifluoro-1- hydroxy-1-trifluoromethylethyl)phenyl)benzenesulfonamide,

Complexity	684
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	481.039g/mol
Formal Charge	0
Heavy Atom Count	31
Hydrogen Bond Acceptor Count	13
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	481.333g/mol
Monoisotopic Mass	481.039g/mol
Rotatable Bond Count	5
Topological Polar Surface Area	66A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	4.9

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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