AG00DD0D

459424-72-7 | 1-Iodo-2,3,4-Trifluorobenzene

AG00DD0D

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CAS Number	459424-72-7
Catalog Number	AG00DD0D(AGN-PC-0KKZFS)
Chemical Name	1-Iodo-2,3,4-Trifluorobenzene
IUPAC Name	1,2,3-trifluoro-4-iodobenzene
InChI	InChI=1S/C6H2F3I/c7-3-1-2-4(10)6(9)5(3)8/h1-2H
InChI Key	YDSUNVSIBZATIU-UHFFFAOYSA-N
MDL Number	MFCD03788551
Molecular Formula	C6H2F3I
Molecular Weight	257.9798
SMILES	FC1=C(F)C(F)=C(I)C=C1
Synonyms	1,2,3-trifluoro-4-iodobenzene, 459424-72-7, 2,3,4-Trifluoroiodobenzene, 1-iodo-2,3,4-trifluorobenzene, Benzene, trifluoroiodo-, 4-Iodo-1,2,3-trifluorobenzene, 1,2,3-trifluoro-4-iodo-benzene, PubChem24001, AC1MCV4E, SCHEMBL80987, 2,3,4-trifluoro-1-iodobenzene, CTK4I9021, KS-00000QGM, YDSUNVSIBZATIU-UHFFFAOYSA-N, ZINC2510751, 6315AB, ANW-65820, MFCD03788551, SBB101938, AKOS007930914, ACN-055836, AS00117, RTR-036837, AJ-36500, AK-87524, AN-28275, DS-18337, SY041536, TR-036837, FT-0677347, MFCD03788551 (95%), C-5261, I01-15178, 2,4,5-Trifluoroiodobenzene, C6H2F3I, CID2779253, 1190385-23-9, 17533-08-3,

Complexity	120
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	257.915g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	257.982g/mol
Monoisotopic Mass	257.915g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	0A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.9

GHS Hazard and Precautionary Statements

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

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