AG003KAW

456-71-3 | 4-(Trifluoromethoxy)benzamide

AG003KAW

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CAS Number	456-71-3
Catalog Number	AG003KAW(AGN-PC-0JL871)
Chemical Name	4-(Trifluoromethoxy)benzamide
IUPAC Name	4-(trifluoromethoxy)benzamide
InChI	InChI=1S/C8H6F3NO2/c9-8(10,11)14-6-3-1-5(2-4-6)7(12)13/h1-4H,(H2,12,13)
InChI Key	IDIXWLCRJFBQJA-UHFFFAOYSA-N
MDL Number	MFCD00041384
Molecular Formula	C8H6F3NO2
Molecular Weight	205.1339
SMILES	O=C(N)C1=CC=C(OC(F)(F)F)C=C1
Synonyms	4-(Trifluoromethoxy)benzamide, 456-71-3, Benzamide, 4-(trifluoromethoxy)-, p-Trifluoromethoxybenzamide, IDIXWLCRJFBQJA-UHFFFAOYSA-N, MFCD00041384, ACMC-20amtu, p-Anisamide, alpha,alpha,alpha-trifluoro-, 4-trifluoromethoxybenzamide, AC1L28UB, 4-Trifluoromethoxy-benzamide, 4-(Trifluoromethoxy)benzamid, SCHEMBL324161, 4-(trifluoromethyloxy)benzamide, DTXSID3073187, 4-(Trifluoromethoxy)benzamide #, CTK1D8091, KS-00003QWK, ZINC156211, 3932AE, CT-859, SBB093437, AKOS003626057, MCULE-2050456818, PS-6806, VZ27978, 4-(carbamoyl)phenyltrifluoromethyl ether, ZB006246, DB-051328, TR-017311, 4-(TRIFLUOROMETHOXY)BENZAMIDE, 97%, CS-0081110, FT-0616874, ST50406882, C-5433, A826872, I01-14846, zvr doxfff, C8H6F3NO2, C8-H6-F3-N-O2, CID68013, AR-1L8447, ZINC00156211, 4907-69-1,

Complexity	209
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	205.035g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	205.136g/mol
Monoisotopic Mass	205.035g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	52.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.1

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

Certificate of Analysis

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