AG0084CA

1077-01-6 | 1-Fluoro-3-(trifluoromethoxy)benzene

AG0084CA

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CAS Number	1077-01-6
Catalog Number	AG0084CA(AGN-PC-0KKY4K)
Chemical Name	1-Fluoro-3-(trifluoromethoxy)benzene
IUPAC Name	1-fluoro-3-(trifluoromethoxy)benzene
InChI	InChI=1S/C7H4F4O/c8-5-2-1-3-6(4-5)12-7(9,10)11/h1-4H
InChI Key	AUKDFDQPJWJEDH-UHFFFAOYSA-N
MDL Number	MFCD00236323
Molecular Formula	C7H4F4O
Molecular Weight	180.0997
SMILES	FC(F)(F)OC1=CC(F)=CC=C1
Synonyms	3-(Trifluoromethoxy)fluorobenzene, 1-fluoro-3-(trifluoromethoxy)benzene, 1077-01-6, 3-fluorotrifluoromethoxybenzene, 3-(Trifluoromethoxy) fluorobenzene, alpha,alpha,alpha,3-Tetrafluoroanisole, M-FLUOROTRIFLUOROMETHOXYBENZENE, Benzene, 1-fluoro-3-(trifluoromethoxy)-, m-fluoro trifluoromethoxy benzene, 1-FLUORO-3- (TRIFLUOROMETHOXY)BENZENE, PubChem4618, AC1MCRLM, ACMC-1BQLB, 3-fluorotrifluoromethoxybenzen, KSC494M6R, SCHEMBL254534, CTK3J4668, trifluoro(3-fluorophenoxy)methane, DTXSID20380452, AUKDFDQPJWJEDH-UHFFFAOYSA-N, 1-fluoro-3-trifluoromethoxybenzene, 1-fluoro-3-trifluoromethoxy-benzene, ACT12780, CS-D1690, KS-00000X4D, ZINC2560217, 3-Fluorophenyl trifluoromethyl ether, ANW-15839, BBL102194, MFCD00236323, SBB089619, STL555993, AKOS006230387, AS04765, LF10306, RP24115, RP24117, RTR-033982, VZ26136, 1-fluoranyl-3-(trifluoromethyloxy)benzene, 3-(trifluoromethoxy)fluorobenzene, 97+%, AC-26097, AJ-40517, AK-88368, AN-48454, BC678729, I122, PS-11656, SC-00284, SY018297, AB0013494, DB-023690, ST2403433, TL8000269, TR-033982, F0569, FT-0613912, 3-(Trifluoromethoxy)fluorobenzene, AldrichCPR, MFCD00236323 (98%), B-6410, 077T016, A801744, I01-1727, J-511010, C7H4F4O, CID2777286, 3-fluoro(trifluoromethoxy)benzene - 5G 5g, A2098,

Complexity	145
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	180.02g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	180.102g/mol
Monoisotopic Mass	180.02g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	9.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code	\N

Certificate of Analysis

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