AG003LF4

402-44-8 | Benzene, 1-​fluoro-​4-​(trifluoromethyl)​-

AG003LF4

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CAS Number	402-44-8
Catalog Number	AG003LF4(AGN-PC-0JL83P)
Chemical Name	Benzene, 1-​fluoro-​4-​(trifluoromethyl)​-
EC Number	206-944-1
IUPAC Name	1-fluoro-4-(trifluoromethyl)benzene
InChI	InChI=1S/C7H4F4/c8-6-3-1-5(2-4-6)7(9,10)11/h1-4H
InChI Key	UNNNAIWPDLRVRN-UHFFFAOYSA-N
MDL Number	MFCD00000399
Molecular Formula	C7H4F4
Molecular Weight	164.1003
NSC Number	88289
SMILES	C(F)(F)(F)c1ccc(cc1)F
Synonyms	4-Fluorobenzotrifluoride, 402-44-8, 1-Fluoro-4-(trifluoromethyl)benzene, p-Fluorobenzotrifluoride, Benzene, 1-fluoro-4-(trifluoromethyl)-, alpha,alpha,alpha,4-Tetrafluorotoluene, p-Fluorotrifluoromethylbenzene, p-(Trifluoromethyl)fluorobenzene, 4-Flourobenzotrifluoride, MFCD00000399, NSC 88289, UNNNAIWPDLRVRN-UHFFFAOYSA-N, A,A,A,4-TETRAFLUOROTOLUENE, 4-(TRIFLUOROMETHYL)FLUOROBENZENE, fxffr df, 4-fluoro-1-(trifluoromethyl)benzene, NSC88289, EINECS 206-944-1, alpha,alpha,alpha,p-Tetrafluorotoluene, PubChem5437, Toluene, p,alpha,alpha,alpha-tetrafluoro-, p-fluoro-benzotrifluoride, 4-fluoro benzotrifluoride, 4-fluoro-benzotrifluoride, 4-fluorobenzo-trifluoride, AC1Q4JPQ, AC1L28IT, AC1Q4M0D, NCIOpen2_001285, 4-trifluoromethylfluorobenzene, KSC915K2R, SCHEMBL168026, 4-Fluorobenzotrifluoride, 98%, TPC-I127, Jsp006958, DTXSID5059951, CTK8B5528, KS-00000EVM, 1-fluoro-4-trifluoromethylbenzene, 4-trifluoromethyl-1-fluorobenzene, fluoro-4-(trifluoromethyl)benzene, 4-(Trifluoromethyl)phenyl fluoride, ZINC164437, 1-fluoro-4-trifluoromethyl benzene, 1-fluoro-4-trifluoromethyl-benzene, ACT01147, JRD-0200, ANW-49042, NSC-88289, SBB087758, .alpha.,.alpha.,p-Tetrafluorotoluene, 1-fluoro-4-(trifluoromethyl)-benzene, p,.alpha.,.alpha.-Tetrafluorotoluene, AKOS006222985, AS01030, CS-W010841, LF10126, MCULE-4898626363, RP22673, RTR-016070, AC-11404, AJ-16154, AN-44762, BR-53800, SC-04271, ZB008141, ST2415341, TC-068400, F0357, FT-0081706, FT-0618515, ST50406422, W6070, .alpha.,.alpha.,.alpha.,p-Tetrafluorotoluene, EN300-64689, p,.alpha.,.alpha.,.alpha.-Tetrafluorotoluene, M-6010, Toluene, p,.alpha.,.alpha.,.alpha.-tetrafluoro-, I01-2554, W-106374, F8881-5159, InChI=1/C7H4F4/c8-6-3-1-5(2-4-6)7(9,10)11/h1-4, C7H4F4, 4-Fluorobezotrifluoride - 5G 5g, C7-H4-F4, CID67873, AR-1J1100, ACN-055938, 4-Fluorobenzotrifluoride, 99% - 25G 25g, Toluene,.alpha.,.alpha.,.alpha.-tetrafluoro-, 6-(tert-Butoxycarbonyl-)-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-2-carboxylic acid, 165947-51-3, 424-58-8,

Complexity	121
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	164.025g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	164.103g/mol
Monoisotopic Mass	164.025g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	0A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	3
Hazard statements	H225-H315-H319-H335
Packing Group	Ⅱ
Precautionary statements	P210-P261-P305+P351+P338
Signal Words	danger
UN Code	UN 1993

Certificate of Analysis

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