AG002JEY

207986-20-7 | Benzamide, 3-fluoro-5-(trifluoromethyl)-

AG002JEY

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CAS Number	207986-20-7
Catalog Number	AG002JEY(AGN-PC-0QWMWX)
Chemical Name	Benzamide, 3-fluoro-5-(trifluoromethyl)-
IUPAC Name	3-fluoro-5-(trifluoromethyl)benzamide
InChI	InChI=1S/C8H5F4NO/c9-6-2-4(7(13)14)1-5(3-6)8(10,11)12/h1-3H,(H2,13,14)
InChI Key	BBUBHNZCRQRAQG-UHFFFAOYSA-N
MDL Number	MFCD00061149
Molecular Formula	C8H5F4NO
Molecular Weight	207.1250
SMILES	O=C(N)C1=CC(C(F)(F)F)=CC(F)=C1
Synonyms	3-Fluoro-5-(trifluoromethyl)benzamide, 207986-20-7, BBUBHNZCRQRAQG-UHFFFAOYSA-N, MFCD00061149, 5-fluoro-3-(trifluoromethyl)benzamide, ACMC-1CMGV, AC1MC7GV, SCHEMBL628456, CTK4E5141, DTXSID50372128, ZINC156351, JRD-0538, 3-fluoro-5-trifluoromethyl-benzamide, 7078AD, SBB093808, AKOS015853133, MCULE-5700915443, PS-8065, VZ26842, KS-00003R70, 3-fluoranyl-5-(trifluoromethyl)benzamide, Benzamide,3-fluoro-5-(trifluoromethyl)-, ZB006302, Benzamide, 3-fluoro-5-(trifluoromethyl)-, alpha,alpha,alpha,5-Tetrafluoro-m-toluamide, DB-045387, TR-009773, FT-0615701, ST50408155, C-5540, A814920, I01-15311, C8H5F4NO, ZINC00156351, CID2737544,

Complexity	228
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	207.031g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	207.128g/mol
Monoisotopic Mass	207.031g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	43.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.8

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319-H335
Packing Group
Precautionary statements	P261-P280a-P304+P340-P305+P351+P338-P405-P501a
UN Code

Certificate of Analysis

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