AG00IAV2

6140-17-6 | Benzene, 1-methyl-4-(trifluoromethyl)-

AG00IAV2

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CAS Number	6140-17-6
Catalog Number	AG00IAV2(AGN-PC-0JLSIW)
Chemical Name	Benzene, 1-methyl-4-(trifluoromethyl)-
EC Number	228-124-2
IUPAC Name	1-methyl-4-(trifluoromethyl)benzene
InChI	InChI=1S/C8H7F3/c1-6-2-4-7(5-3-6)8(9,10)11/h2-5H,1H3
InChI Key	LRLRAYMYEXQKID-UHFFFAOYSA-N
MDL Number	MFCD00075476
Molecular Formula	C8H7F3
Molecular Weight	160.1364
SMILES	CC1=CC=C(C=C1)C(F)(F)F
Synonyms	4-Methylbenzotrifluoride, 6140-17-6, 1-methyl-4-(trifluoromethyl)benzene, 4-(trifluoromethyl)toluene, p-methylbenzotrifluoride, alpha,alpha,alpha-Trifluoro-p-xylene, Benzene, 1-methyl-4-(trifluoromethyl)-, MFCD00075476, 4-methyl-1-(trifluoromethyl)benzene, 4-Methylbenzotrifluoride, 98%, AK-72556, W-105158, EINECS 228-124-2, 1-methyl-4-(trifluormethyl)benzol, PubChem1659, p-trifluoromethyltoluene, 4-Trifluoromethyltoluene, ACMC-209msf, p-Xylene, .alpha.,.alpha.,.alpha.-trifluoro-, AC1Q4JO9, SCHEMBL91414, AC1L2Z17, DTXSID10210335, PC5067C, LRLRAYMYEXQKID-UHFFFAOYSA-N, ACT13125, KS-00000L5A, ZINC2545372, ZX-AP010904, ANW-33805, FCH932068, KM0504, SBB087416, 1-methyl-4-(trifluoromethyl)-benzene, AKOS005145703, AC-4151, AM62046, AS01764, CM13257, LF10162, RTR-030893, VZ29406, AJ-39307, AN-12274, AT-12813, CC-19903, SC-05745, TS-02121, AB0012317, AX8041857, ST2415422, TC-068070, TL8003892, FT-0619065, M2945, ST50405269, 140M176, C-03957, C8H7F3, ?,?,?-Trifluoro-p-xylene, 4-Chloro-1,1-diethoxy-butane, C8-H7-F3, CID80230, 4-Chlorobutyraldehyde diethyl acetal, AR-1C4572, ACN-055966, 4-Methylbenzotrifluoride, 98% - 1G 1g, 6-Benzyl-4-chloro-4,5,6,7-tetrahydro-3H-pyrrolo[3,4-d]pyrimidine HCl, 1190927-80-0, 6275-91-8,

Complexity	120
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	160.05g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	160.139g/mol
Monoisotopic Mass	160.05g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	0A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	3
Hazard statements	H226-H315-H319-H335
Packing Group	Ⅲ
Precautionary statements	P210-P261-P303+P361+P353-P305+P351+P338-P405-P501a
UN Code	UN 1993

Certificate of Analysis

Lot Number