AG003ICJ

1868-00-4 | Bis(3-(trifluoromethyl)phenyl)methanone

AG003ICJ

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CAS Number	1868-00-4
Catalog Number	AG003ICJ(AGN-PC-0JTKIQ)
Chemical Name	Bis(3-(trifluoromethyl)phenyl)methanone
IUPAC Name	bis[3-(trifluoromethyl)phenyl]methanone
InChI	InChI=1S/C15H8F6O/c16-14(17,18)11-5-1-3-9(7-11)13(22)10-4-2-6-12(8-10)15(19,20)21/h1-8H
InChI Key	POOXOHISLGOAEF-UHFFFAOYSA-N
MDL Number	MFCD00000390
Molecular Formula	C15H8F6O
Molecular Weight	318.2138
SMILES	O=C(C1=CC=CC(C(F)(F)F)=C1)C2=CC=CC(C(F)(F)F)=C2
Synonyms	3,3'-Bis(trifluoromethyl)benzophenone, 1868-00-4, bis(3-(trifluoromethyl)phenyl)methanone, Bis[3-(trifluoromethyl)phenyl]methanone, 3,3'-di(Trifluoromethyl)benzophenone, POOXOHISLGOAEF-UHFFFAOYSA-N, 3,3'-bis(trifluoromethyl),benzophenone, di3-(trifluoromethyl)phenyl ketone, PubChem6402, AC1LCDEU, ACMC-1CHTZ, SCHEMBL1237189, CTK4D9351, DTXSID10344826, ZINC120251, KS-000016PU, ZX-AP000980, 3,3-bis(trifluoromethyl)benzophenone, ANW-23307, LABOTEST-BB LT00159871, MFCD00000390, PC3101, SBB057313, AKOS005257738, AS02924, MCULE-2470086284, PS-7058, 3,3'-bis-(Trifluoromethyl)benzophenone, AK305763, CC-12872, ZB004085, Bis[3-(trifluoromethyl)phenyl]methanone #, Methanone,bis[3-(trifluoromethyl)phenyl]-, DB-044616, TR-008634, B3217, FT-0614034, ST50307054, A813084, C-19548, J-012009, I01-14774, CID599788, ZINC00120251, 3,3/'-Bis(trifluoromethyl)benzophenone,

Complexity	364
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	318.048g/mol
Formal Charge	0
Heavy Atom Count	22
Hydrogen Bond Acceptor Count	7
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	318.218g/mol
Monoisotopic Mass	318.048g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	17.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	5

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319
Packing Group
Precautionary statements	P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313
UN Code

Certificate of Analysis

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