AG0032SD

103962-05-6 | 1-Iodo-4-(trifluoromethoxy)benzene

AG0032SD

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CAS Number	103962-05-6
Catalog Number	AG0032SD(AGN-PC-0KKY4R)
Chemical Name	1-Iodo-4-(trifluoromethoxy)benzene
IUPAC Name	1-iodo-4-(trifluoromethoxy)benzene
InChI	InChI=1S/C7H4F3IO/c8-7(9,10)12-6-3-1-5(11)2-4-6/h1-4H
InChI Key	RTUDBROGOZBBIC-UHFFFAOYSA-N
MDL Number	MFCD00042411
Molecular Formula	C7H4F3IO
Molecular Weight	288.0057
SMILES	IC1=CC=C(C=C1)OC(F)(F)F
Synonyms	1-Iodo-4-(trifluoromethoxy)benzene, 103962-05-6, 4-(Trifluoromethoxy)iodobenzene, 1-Iado-4-(trifluoromethoxy)benzene, 4-iodotrifluoromethoxybenzene, p-(trifluoromethoxy)iodobenzene, 4-(Trifluoromethoxy)-iodobenzene, 1-iodo-4-trifluoromethoxy-benzene, MFCD00042411, 4-(Trifluoromethoxy)iodobenzene, 97%, Benzene, 1-iodo-4-(trifluoromethoxy)-, alpha,alpha,alpha-Trifluoro-4-iodoanisole, 4-Iodo-alpha,alpha,alpha-trifluoromethoxybenzene, PubChem1078, AC1MCRLU, p-iodotrifluoromethoxybenzene, 4-trifluoromethoxyiodobenzene, SCHEMBL80634, 4-trifluoromethoxy-iodobenzene, KSC490I9B, ACMC-20989z, 4-iodo trifluoromethoxy benzene, Jsp000399, 1-Iodo-4-trifluoromethoxybenzene, 4-(Trifluoromethoxy) iodobenzene, 4-iodo-1-trifluoromethoxybenzene, CTK3J0490, RTUDBROGOZBBIC-UHFFFAOYSA-, DTXSID20380457, RTUDBROGOZBBIC-UHFFFAOYSA-N, ZINC167109, 4-iodo-1-(trifluoromethoxy)benzene, ACT12669, BUTTPARK 167\11-95, ANW-14997, WT1408, AKOS005259772, AC-6889, AN-9558, AS01590, CS-W004081, LF10312, MCULE-7020269374, PS-7177, RTR-000913, TRA0024777, 4-IODOPHENYL TRIFLUOROMETHYL ETHER, AJ-16590, AK-39882, BR-39882, CJ-02358, SC-00164, SY016451, ZB008742, AB0012624, DB-023681, TL8000169, TR-000913, AM20050276, FT-0616893, ST24027098, ST51041558, MFCD00042411 (97%), C-4682, 4-IODO-ALPHA,ALPHA,ALPHA-TRIFLUOROANISOLE, 103962-05-6 1-Iodo-4-(trifluoromethoxy)benzene, I01-0764, J-001075, InChI=1/C7H4F3IO/c8-7(9,10)12-6-3-1-5(11)2-4-6/h1-4H, C7H4F3IO, ZINC00167109, ACN-056109, CID2777294, A1473, T2153, 4-(Trifluoromethoxy)iodobenzene, 97% - 100G 100g,

Complexity	140
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	287.926g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	288.008g/mol
Monoisotopic Mass	287.926g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	9.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.8

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H227-H315-H319-H335
Packing Group
Precautionary statements	P210-P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313-P403+P235-P501-P261-P305+P351+P338-P280a-P304+P340-P405-P501a
UN Code

Certificate of Analysis

Lot Number