AG00E94T

59382-39-7 | 2-Fluoro-5-iodobenzotrifluoride

AG00E94T

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CAS Number	59382-39-7
Catalog Number	AG00E94T(AGN-PC-0KK8GJ)
Chemical Name	2-Fluoro-5-iodobenzotrifluoride
IUPAC Name	1-fluoro-4-iodo-2-(trifluoromethyl)benzene
InChI	InChI=1S/C7H3F4I/c8-6-2-1-4(12)3-5(6)7(9,10)11/h1-3H
InChI Key	DKLKYTATXLQGMX-UHFFFAOYSA-N
MDL Number	MFCD00236678
Molecular Formula	C7H3F4I
Molecular Weight	289.9968
SMILES	FC1=C(C=C(I)C=C1)C(F)(F)F
Synonyms	1-fluoro-4-iodo-2-(trifluoromethyl)benzene, 59382-39-7, 2-Fluoro-5-iodobenzotrifluoride, Benzene, 1-fluoro-4-iodo-2-(trifluoromethyl)-, AC1MC75X, SCHEMBL80848, CTK7C3189, DTXSID10372003, DKLKYTATXLQGMX-UHFFFAOYSA-N, ZINC2560322, 8841AB, ANW-54911, MFCD00236678, AKOS009157559, AM61588, RTR-039830, 1-fluoro-4-iodo-2-trifluoromethylbenzene, AJ-40550, AK-86304, DS-18162, ST2415342, F1161, FT-0652341, C-5171, 1-fluoranyl-4-iodanyl-2-(trifluoromethyl)benzene, 236F678, A832294, I01-6785, 1-Fluoro-4-iodo-2-(trifluoromethyl)benzene, AldrichCPR, C7H3F4I, CID2737344, 928783-87-3,

Complexity	156
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	289.922g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	289.999g/mol
Monoisotopic Mass	289.922g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	0A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.6

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H312-H315-H319-H332-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number