AG0039BZ

25449-96-1 | 2-Methyl-5-(trifluoromethyl)aniline

AG0039BZ

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CAS Number	25449-96-1
Catalog Number	AG0039BZ(AGN-PC-0KK7GC)
Chemical Name	2-Methyl-5-(trifluoromethyl)aniline
IUPAC Name	2-methyl-5-(trifluoromethyl)aniline
InChI	InChI=1S/C8H8F3N/c1-5-2-3-6(4-7(5)12)8(9,10)11/h2-4H,12H2,1H3
InChI Key	BCLCKENDTZITFB-UHFFFAOYSA-N
MDL Number	MFCD00134580
Molecular Formula	C8H8F3N
Molecular Weight	175.1510
SMILES	CC1=C(N)C=C(C=C1)C(F)(F)F
Synonyms	3-Amino-4-methylbenzotrifluoride, 25449-96-1, 2-Methyl-5-(trifluoromethyl)aniline, 2-methyl-5-trifluoromethylaniline, Benzenamine, 2-methyl-5-trifluoromethyl, Benzenamine, 2-methyl-5-(trifluoromethyl)-, MFCD00134580, 2-methyl-5-(trifluoromethyl)phenylamine, PubChem4494, AC1MC4FY, Intermediates-ZCF02681, ACMC-209gk1, 5-Trifluoromethyl-o-toluidine, SCHEMBL330442, Jsp005045, CTK6B9587, KS-00000ZWZ, 5-trifluoromethyl-2-methylaniline, DTXSID50371030, 3-amino-4-methyl-benzotrifluoride, BCLCKENDTZITFB-UHFFFAOYSA-N, WT259, 2-Amino-4-(trifluoromethyl)toluene, 2-Methyl-5-(trifluoromethyl)anilin, ACT11506, JRD-0381, ZINC2504733, ANW-25727, CL8403, CM-006, SBB089009, AKOS005063635, AC-3699, AM61867, AS04101, CM11509, CS-W017460, LF10038, LS11365, MCULE-2676531765, PS-8606, RP23698, RTR-011625, VZ26302, 2-methyl-5-(trifluoromethyl)benzenamine, AJ-36033, AN-12685, BR-34373, CJ-08463, R403, SC-02911, 3-AMINO-4-(TRIFLUOROMETHYL)TOLUENE, AB0018141, TL8002066, FT-0614990, M2301, ST24028389, ST50407181, 3-Amino-4-methylbenzotrifluoride, AldrichCPR, B-8072, 25449-96-1 3-amino-4-methylbenzotrifluoride, 449A961, I01-3521, J-509993, C8H8F3N, 2,2,2,4'-Tetrafluoroacetophenone, ZINC02504733, ACN-055885, CID2735933, 2-methyl-5-trifluoromethylaniline(MTA), A5130, 3-(methylsulfonyl)-5-(2-thienyl)isoxazole-4-carbonitrile, MTA, 25499-96-1,

Complexity	155
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	175.061g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	175.154g/mol
Monoisotopic Mass	175.061g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	26A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	6.1
Hazard statements	H302-H312-H315-H319-H331-H335
Packing Group	Ⅲ
Precautionary statements	P261-P280-P305+P351+P338-P311
UN Code	UN 2811

Certificate of Analysis

Lot Number