AG0045S7

883543-26-8 | 2-(Chloromethyl)-1-fluoro-4-(trifluoromethyl)benzene

AG0045S7

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CAS Number	883543-26-8
Catalog Number	AG0045S7(AGN-PC-0VKW3C)
Chemical Name	2-(Chloromethyl)-1-fluoro-4-(trifluoromethyl)benzene
IUPAC Name	2-(chloromethyl)-1-fluoro-4-(trifluoromethyl)benzene
InChI	InChI=1S/C8H5ClF4/c9-4-5-3-6(8(11,12)13)1-2-7(5)10/h1-3H,4H2
InChI Key	OZGWDDBROIXNRQ-UHFFFAOYSA-N
MDL Number	MFCD05864315
Molecular Formula	C8H5ClF4
Molecular Weight	212.5719
SMILES	FC(C1=CC=C(F)C(CCl)=C1)(F)F
Synonyms	883543-26-8, 2-fluoro-5-(trifluoromethyl)benzyl chloride, 2-(chloromethyl)-1-fluoro-4-(trifluoromethyl)benzene, 2-Fluoro-5-trifluoromethylbenzyl chloride, 2-fluoro-5-trifluoromethylbenzylchloride, 2-fluoro-5-(trifluoromethyl)benzylchloride, PubChem4931, AC1MBZSH, SCHEMBL16758990, CTK5F9683, DTXSID90374666, ACT13241, ZINC2559528, ANW-55594, CK1014, MFCD05864315, SBB070787, AKOS005255570, AC-7452, AM62582, AN-6278, AS01869, RTR-042825, AJ-40278, PS-10649, 2-fluoro-5-trifluoromethyl benzyl chloride, AB0030454, ST2416182, TR-042825, FT-0646651, X2652, A22660, 2-Chloromethyl-1-fluoro-4-trifluoromethyl-benzene, I01-4994, {[2-fluoro-5-(trifluoromethyl)phenyl]methyl}chloranuide, Benzene,2-(chloromethyl)-1-fluoro-4-(trifluoromethyl)-, 2-(chloromethyl)-1-fluoro-4-(trifluoromethyl)benzene, 3-(chloromethyl)-4-fluorobenzotrifluoride, C8H5ClF4, CID2759166,

Complexity	168
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	212.002g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	212.572g/mol
Monoisotopic Mass	212.002g/mol
Rotatable Bond Count	1
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	8
Hazard statements	H302-H312-H314-H332
Packing Group	Ⅲ
Precautionary statements	P260-P261-P264-P270-P271-P280-P301+P312-P301+P330+P331-P302+P352-P303+P361+P353-P304+P340-P305+P351+P338-P310-P312-P321-P322-P330-P363-P405-P501
UN Code	UN 1760

Certificate of Analysis

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