AG003LE0

61721-07-1 | 4-FLUORO-3-TRIFLUOROMETHYLPHENOL

AG003LE0

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CAS Number	61721-07-1
Catalog Number	AG003LE0(AGN-PC-0JTLSU)
Chemical Name	4-FLUORO-3-TRIFLUOROMETHYLPHENOL
IUPAC Name	4-fluoro-3-(trifluoromethyl)phenol
InChI	InChI=1S/C7H4F4O/c8-6-2-1-4(12)3-5(6)7(9,10)11/h1-3,12H
InChI Key	DHPCRFYUUWAGAH-UHFFFAOYSA-N
MDL Number	MFCD00043875
Molecular Formula	C7H4F4O
Molecular Weight	180.0997
SMILES	OC1=CC=C(F)C(C(F)(F)F)=C1
Synonyms	4-Fluoro-3-(trifluoromethyl)phenol, 61721-07-1, 4-fluoro-3-trifluoromethylphenol, 2-Fluoro-5-hydroxybenzotrifluoride, 3-trifluoromethyl-4-fluorophenol, phenol, 4-fluoro-3-(trifluoromethyl)-, 4-fluoro-3-trifluoromethyl phenol, DHPCRFYUUWAGAH-UHFFFAOYSA-N, ALPHA,ALPHA,ALPHA-4-TETRAFLUORO-M-CRESOL, MFCD00043875, FHBTF, PubChem4147, AC1LCKHK, ACMC-209mvr, AC1Q78VG, KSC495A2B, SCHEMBL156681, CTK3J5020, DTXSID70345096, 3-trifluoromethyl-4-fluoro phenol, 4-fluoro-3-trifluoromethyl-phenol, ZINC164785, 3-(trifluoromethyl)-4-fluorophenol, ACT00579, JRD-0275, 4-fluoro-3-(trifluoromethyl)-phenol, ANW-33925, CL8505, SBB089614, 4-Fluoro-3-(trifluoromethyl)phenol #, AKOS005255939, AC-8274, AN-8148, AS05499, CM11781, MCULE-5896259945, PS-8540, RP24118, RTC-060516, TF10031, TRA0063932, VZ29019, KS-0000098N, alpha,alpha,alpha,4-Tetrafluoro-m-cresol, AJ-16285, AK-30250, BR-30250, CJ-02223, SC-05780, ZB008295, AB0010822, AB1010848, ST2411427, TC-060516, A1749, AM20040867, F0754, FT-0085007, FT-0618475, ST50827037, M-2627, 4-Fluoro-3-(trifluoromethyl)phenol, AldrichCPR, I01-1292, J-515386, 2-Fluoro-5-hydroxybenzotrifluoride; |A,|A,|A,4-Tetrafluoro-m-cresol, 4-Fluoro-3- phenol, C7H4F4O, CID601854, ZINC00164785, ACN-055933, 4-Fluoro-3-(trifluoromethyl)phenol, 98% - 1G 1g, 106032-61-5,

Complexity	156
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	1
Isotope Atom Count	0
Molecular Weight	180.102g/mol
Monoisotopic Mass	180.02g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	20.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.6

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	8
Hazard statements	H302+H332-H314-H317-H411
Packing Group	Ⅱ
Precautionary statements	P273-P280-P305+P351+P338-P310
UN Code	UN 3265

Certificate of Analysis

Lot Number