AG006IZU

672-58-2 | 3-(Trifluoromethyl)benzenesulfonamide

AG006IZU

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CAS Number	672-58-2
Catalog Number	AG006IZU(AGN-PC-0JOHQF)
Chemical Name	3-(Trifluoromethyl)benzenesulfonamide
IUPAC Name	3-(trifluoromethyl)benzenesulfonamide
InChI	InChI=1S/C7H6F3NO2S/c8-7(9,10)5-2-1-3-6(4-5)14(11,12)13/h1-4H,(H2,11,12,13)
InChI Key	ZUTVRDMZQSHCID-UHFFFAOYSA-N
MDL Number	MFCD00042421
Molecular Formula	C7H6F3NO2S
Molecular Weight	225.1882
NSC Number	54561
SMILES	O=S(C1=CC=CC(C(F)(F)F)=C1)(N)=O
Synonyms	3-(Trifluoromethyl)benzenesulfonamide, 672-58-2, 3-(trifluoromethyl)benzene-1-sulfonamide, 3-(trifluoromethyl)benzenesulphonamide, m-trifluoromethylbenzenesulfonamide, 3-trifluoromethylbenzenesulfonamide, MFCD00042421, Benzenesulfonamide, 3-(trifluoromethyl)-, NSC54561, PubChem11763, AC1L6CWX, AC1Q4JTS, Maybridge3_000947, 3-Sulphamoylbenzotrifluoride, KSC493O8T, SCHEMBL962772, AC1Q558O, CHEMBL2180606, CTK3J3789, DTXSID70288176, ZUTVRDMZQSHCID-UHFFFAOYSA-N, HMS1433L01, ZINC138322, 3-trifluoromethyl-benzenesulfonamide, m-Trifluoromethylbenzene sulphonamide, NSC-54561, SBB096804, 3-(trifluoromethyl) benzenesulfonamide, 3-(trifluoromethyl)-benzenesulfonamide, AKOS000138313, AS02462, CCG-243532, CS-W013044, MCULE-6502042502, PS-7778, TRA0029536, VZ26150, IDI1_012334, AJ-12345, AN-47167, CJ-01045, Q985, SY016262, ZB004856, 3-(Trifluoromethyl)benzenesulfonamide, 97%, AB0017931, DB-021767, RT-001703, 4CH-022061, FT-0081718, FT-0613925, ST24041692, ST50320223, 3-(TRIFLUOROMETHYL)BENZENE SULFONAMIDE, EN300-26072, MFCD00042421 (95%), M-1906, 79393-EP2305695A2, 79393-EP2305696A2, 79393-EP2305697A2, 79393-EP2305698A2, alpha,alpha,alpha-Trifluorotoluene-3-sulfonamide, 672T582, Z45415577, F0191-5454, C7H6F3NO2S, 3- BENZENESULFONAMIDE, ACN-S002596, 2-(Trifluoromethyl)benzenesulfonamide, AR-1E8067, CID244076, T2925, 3-(Trifluoromethyl)benzenesulfonamide, 95% - 1G 1g, 7789-77-7,

Complexity	293
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	225.007g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	225.185g/mol
Monoisotopic Mass	225.007g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	68.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P301+P312-P302+P352-P304+P340-P305+P351+P338
UN Code	\N

Certificate of Analysis

Lot Number