AG00GX5F

887268-09-9 | 2,6-Bis(trifluoromethyl)fluorobenzene

AG00GX5F

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CAS Number	887268-09-9
Catalog Number	AG00GX5F(AGN-PC-0WBR6G)
Chemical Name	2,6-Bis(trifluoromethyl)fluorobenzene
IUPAC Name	2-fluoro-1,3-bis(trifluoromethyl)benzene
InChI	InChI=1S/C8H3F7/c9-6-4(7(10,11)12)2-1-3-5(6)8(13,14)15/h1-3H
InChI Key	YSCWHYSFVNCLNL-UHFFFAOYSA-N
MDL Number	MFCD04972866
Molecular Formula	C8H3F7
Molecular Weight	232.0982
SMILES	FC1=C(C=CC=C1C(F)(F)F)C(F)(F)F
Synonyms	2-Fluoro-1,3-bis(trifluoromethyl)benzene, 887268-09-9, 2,6-bis(trifluoromethyl)fluorobenzene, 2-fluoro-1,3-bis-(trifluoromethyl)benzene, 2-Fluoro-1,3-bis-trifluoromethyl-benzene, SCHEMBL7601747, CTK7B6856, DTXSID30660171, ZINC2540314, ZX-AP008656, 4572AC, ANW-55077, BBL103372, MFCD04972866, PC2281, SBB097871, STL557182, AKOS005255760, 2-fluoro-1,3-bistrifluoromethylbenzene, FS-4640, 1,3-bis(trifluoromethyl)-2-fluorobenzene, AJ-39058, AK-76036, AX8194655, ST2404394, TR-055182, 4CH-017561, FT-0678650, Z-1764, I01-15184, C8H3F7,

Complexity	194
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	232.012g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	7
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	232.101g/mol
Monoisotopic Mass	232.012g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	0A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.8

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H227-H315-H319-H335
Packing Group
Precautionary statements	P305+P351+P338
UN Code

Certificate of Analysis

Lot Number