AG003B7Y

69409-98-9 | 2-Fluoro-4-(trifluoromethyl)aniline

AG003B7Y

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CAS Number	69409-98-9
Catalog Number	AG003B7Y(AGN-PC-0KK8OR)
Chemical Name	2-Fluoro-4-(trifluoromethyl)aniline
IUPAC Name	2-fluoro-4-(trifluoromethyl)aniline
InChI	InChI=1S/C7H5F4N/c8-5-3-4(7(9,10)11)1-2-6(5)12/h1-3H,12H2
InChI Key	ARHDUOQIXLGANT-UHFFFAOYSA-N
MDL Number	MFCD01631629
Molecular Formula	C7H5F4N
Molecular Weight	179.1149
SMILES	NC1=CC=C(C(F)(F)F)C=C1F
Synonyms	2-fluoro-4-(trifluoromethyl)aniline, 69409-98-9, 4-Amino-3-fluorobenzotrifluoride, 2-fluoro-4-trifluoromethylaniline, 4-Amino-3-fluorobenzotri-fluoride, 3-FLUORO-4-AMINOBENZOTRIFLUORIDE, Benzenamine, 2-fluoro-4-(trifluoromethyl)-, 2-FLUORO-4-(TRIFLUOROMETHYL)BENZENAMINE, MFCD01631629, 2-fluoro-4-(trifluoromethyl)phenylamine, 2-FLUORO-4-(TRIFLUORMETHYL)ANILINE, PubChem2813, AC1MC7O3, KSC495S4F, SCHEMBL379155, CTK3J5942, a,a,a,2-Tetrafluoro-p-toluidine, DTXSID20372211, ARHDUOQIXLGANT-UHFFFAOYSA-N, WT395, 2-fluoro-4-trifluoromethyl aniline, ACT13151, JRD-0971, ZINC2382347, SBB028383, 2-fluoro-4-(trifluoromethyl) aniline, 2-Fluoro-4-trifluoromethylphenylamine, 2-Fluoro-4-(trifluoromethyl);aniline, 2-fluoro-4-trifluoromethyl-phenylamine, 4-amino-3-fluorotrifluoromethylbenzene, AKOS006229995, 2-fluoranyl-4-(trifluoromethyl)aniline, AC-2330, AM62079, AS01727, CF-1135, CM11486, CS-W007935, LS11497, PF10425, PS-8548, QC-7639, RP24029, RTR-023100, VF10050, KS-0000015T, AJ-34837, AK-36125, AN-14044, BC206852, CJ-08143, SC-06306, SY013567, 4-Amino-3-fluoro-1-trifluoromethylbenzene, AB0068266, DB-024326, ST2404405, TR-023100, 4CH-017930, FT-0656701, V7336, MFCD01631629 (97%), A19813, C-5209, 2-Fluoro-4-(trifluoromethyl)aniline, AldrichCPR, 69409-98-9 3-Fluoro-4-Aminobenzotrifluoride, 409A989, A836486, I01-4943, I01-6689, I01-8456, J-514361, 2-Fluoro-4- aniline, C7H5F4N, 4-Nitro-L-phenylalanine monohydrate, ZINC02382347, ACN-055585, CID2737674,

Complexity	156
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	179.036g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	179.118g/mol
Monoisotopic Mass	179.036g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	26A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	6.1
Hazard statements	H227-H302-H312-H315-H319-H332
Packing Group	Ⅲ
Precautionary statements	P210-P261-P262-P271-P280-P301+P310-P302+P352-P304+P340-P305+P351+P338-P312-P330-P403+P235
UN Code	UN 2810

Certificate of Analysis

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