AG003FEK

2787-79-3 | 2,3,5,6-Tetrafluoro-4-(trifluoromethyl)phenol

AG003FEK

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CAS Number	2787-79-3
Catalog Number	AG003FEK(AGN-PC-0KKXSE)
Chemical Name	2,3,5,6-Tetrafluoro-4-(trifluoromethyl)phenol
IUPAC Name	2,3,5,6-tetrafluoro-4-(trifluoromethyl)phenol
InChI	InChI=1S/C7HF7O/c8-2-1(7(12,13)14)3(9)5(11)6(15)4(2)10/h15H
InChI Key	HZQGKHUTYHEFBT-UHFFFAOYSA-N
MDL Number	MFCD00155984
Molecular Formula	C7HF7O
Molecular Weight	234.0711
SMILES	OC1=C(F)C(F)=C(C(F)(F)F)C(F)=C1F
Synonyms	2,3,5,6-Tetrafluoro-4-(trifluoromethyl)phenol, 2787-79-3, Tetrafluoro-4-(trifluoromethyl)phenol, Phenol,2,3,5,6-tetrafluoro-4-(trifluoromethyl)-, Phenol, 2,3,5,6-tetrafluoro-4-(trifluoromethyl)-, Perfluoro-p-cresol, ACMC-209gzh, AC1MCR8T, SCHEMBL186352, CTK4G0381, DTXSID00380258, 4-trifluoromethyltetrafluoro-phenol, ZINC2530921, ZX-AP008096, ANW-26283, MFCD00155984, PC9563, SBB098169, AKOS015853310, ACM2787793, MCULE-8378720239, AJ-38518, AK135654, SC-41967, AX8065071, TR-012408, FT-0609412, ST51007075, 2,3,5,6-Tetrafluoro-4-hydroxybenzotrifluoride, 4-Hydroxy-2,3,5,6-tetrafluorobenzotrifluoride, Z-0043, alpha,alpha,alpha,2,3,5,6-Heptafluoro-p-cresol, A819225, 2,3,5,6-tetrafluoro-4-(trifluoromethyl)benzaldehyd, J-016907, 2,3,5,6-Tetrafluoro-4-(trifluoromethyl)phenol, 95%, I14-29648, 2,3,5,6-tetrakis(fluoranyl)-4-(trifluoromethyl)phenol, ZINC02530921, CID2776810, T1983, 2,3,5,6-Tetrafluoro-4-(trifluoromethyl)phenol 100g, 2,3,5,6-Tetrafluoro-4-(trifluoromethyl)phenol, 97% - 1G 1g,

Complexity	214
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	233.992g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	8
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	234.073g/mol
Monoisotopic Mass	233.992g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	20.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.9

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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