AG003KB3

65796-00-1 | 1-(Chloromethyl)-4-(trifluoromethoxy)benzene

AG003KB3

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CAS Number	65796-00-1
Catalog Number	AG003KB3(AGN-PC-0KKY3Y)
Chemical Name	1-(Chloromethyl)-4-(trifluoromethoxy)benzene
IUPAC Name	1-(chloromethyl)-4-(trifluoromethoxy)benzene
InChI	InChI=1S/C8H6ClF3O/c9-5-6-1-3-7(4-2-6)13-8(10,11)12/h1-4H,5H2
InChI Key	LBMKFQMJURUPKC-UHFFFAOYSA-N
MDL Number	MFCD00052326
Molecular Formula	C8H6ClF3O
Molecular Weight	210.5808
SMILES	FC(F)(F)OC1=CC=C(CCl)C=C1
Synonyms	4-(Trifluoromethoxy)benzyl Chloride, 65796-00-1, 1-(Chloromethyl)-4-(trifluoromethoxy)benzene, 4-(trifluoromethoxy)benzylchloride, 4-trifluoromethoxybenzyl chloride, MFCD00052326, Benzene, 1-(chloromethyl)-4-(trifluoromethoxy)-, [4-(chloromethyl)phenoxy]trifluoromethane, PubChem5804, AC1MCRKX, ACMC-209ns9, AC1Q4KF9, KSC623C1L, SCHEMBL1008825, p-trifluoromethoxybenzyl chloride, 4-triflouromethoxybenzyl chloride, CTK5C3115, DTXSID40380439, LBMKFQMJURUPKC-UHFFFAOYSA-N, s200, ZINC167139, ACN-S004537, ANW-35095, BBL013499, KM0955, SBB094395, STL145783, AKOS000262290, AM62174, CS-W002250, LF10920, MCULE-5371029385, TRA0056118, VZ27986, 4-chloromethyl-1-trifluoromethoxybenzene, KS-00000D34, 1-chloromethyl-4-trifluoromethoxy-benzene, AJ-16601, AN-38598, CJ-02364, PS-10648, SY014909, ZB008755, 1-(chloromethyl)-4-trifluoromethoxybenzene, 1-(chloromethyl)4-(trifluoromethoxy)benzene, AB0018527, DB-024200, TL8004669, TR-022346, A8907, FT-0616887, ST24037593, ST51041555, 1-(chloromethyl)-4-(trifluoromethyloxy)benzene, Benzene,1-(chloromethyl)-4-(trifluoromethoxy)-, MFCD00052326 (97+%), 796T001, A823387, I01-1525, C8H6ClF3O, 3-(Trifluoromethoxy)benzyl chloride, alpha-Chloro-4-(trifluoromethoxy)toluene, ZINC00167139, CID2777261, T2453, 36823-88-8,

Complexity	152
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	210.006g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	210.58g/mol
Monoisotopic Mass	210.006g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	9.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.5

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	8
Hazard statements	H227-H290-H314
Packing Group	Ⅱ
Precautionary statements	P210-P234-P260-P264-P280-P301+P330+P331+P310-P303+P361+P353+P310+P363-P304+P340+P310-P305+P351+P338+P310-P390-P403+P235-P405-P406-P501
UN Code	UN 1760

Certificate of Analysis

Lot Number