Iodobenzenes

Organic compounds considered aryl halides that consist of a phenyl group with an iodine atom substitution in the following structure: C₆H₅I.

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2-Bromo-5-iodotoluene, 98+%

CAS: 202865-85-8 Molecular Formula: C7H6BrI Molecular Weight (g/mol): 296.933 MDL Number: MFCD00070749 InChI Key: QSQOGKONVJDRNH-UHFFFAOYSA-N Synonym: 2-bromo-5-iodotoluene,benzene,1-bromo-4-iodo-2-methyl,benzene, 1-bromo-4-iodo-2-methyl,pubchem3791,2-bromo-5-iodo toluene,2-bromo-5-iodo-toluene,2-bromo-5-iodotoluene;,acmc-1cq3e,ksc543o8j,1-bromo-2-methyl-4-iodobenzene PubChem CID: 2735574 IUPAC Name: 1-bromo-4-iodo-2-methylbenzene SMILES: CC1=C(C=CC(=C1)I)Br

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PubChem CID	2735574
CAS	202865-85-8
Molecular Weight (g/mol)	296.933
MDL Number	MFCD00070749
SMILES	CC1=C(C=CC(=C1)I)Br
Synonym	2-bromo-5-iodotoluene,benzene,1-bromo-4-iodo-2-methyl,benzene, 1-bromo-4-iodo-2-methyl,pubchem3791,2-bromo-5-iodo toluene,2-bromo-5-iodo-toluene,2-bromo-5-iodotoluene;,acmc-1cq3e,ksc543o8j,1-bromo-2-methyl-4-iodobenzene
IUPAC Name	1-bromo-4-iodo-2-methylbenzene
InChI Key	QSQOGKONVJDRNH-UHFFFAOYSA-N
Molecular Formula	C7H6BrI

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1-Iodo-2,4-dinitrobenzene, 98%

CAS: 709-49-9 Molecular Formula: C6H3IN2O4 Molecular Weight (g/mol): 294.004 MDL Number: MFCD00039738 InChI Key: FXMKXMJLXRTQSW-UHFFFAOYSA-N Synonym: 2,4-dinitroiodobenzene,benzene, 1-iodo-2,4-dinitro,unii-not697x2xm,ccris 7907,4-iodo-1,3-dintrobenzene,6-iodo-1,3-dintrobenzene,2,4-dinitro-1-iodobenzene,not697x2xm,1-iodo-2,4-dinitro-benzene,1-iod-2,4-dinitrobenzol PubChem CID: 69730 ChEBI: CHEBI:59000 IUPAC Name: 1-iodo-2,4-dinitrobenzene SMILES: C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])I

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Specifications

PubChem CID	69730
CAS	709-49-9
Molecular Weight (g/mol)	294.004
ChEBI	CHEBI:59000
MDL Number	MFCD00039738
SMILES	C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])I
Synonym	2,4-dinitroiodobenzene,benzene, 1-iodo-2,4-dinitro,unii-not697x2xm,ccris 7907,4-iodo-1,3-dintrobenzene,6-iodo-1,3-dintrobenzene,2,4-dinitro-1-iodobenzene,not697x2xm,1-iodo-2,4-dinitro-benzene,1-iod-2,4-dinitrobenzol
IUPAC Name	1-iodo-2,4-dinitrobenzene
InChI Key	FXMKXMJLXRTQSW-UHFFFAOYSA-N
Molecular Formula	C6H3IN2O4

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4-Iodoanisole, 98%

CAS: 696-62-8 Molecular Formula: C₇H₇IO Molecular Weight (g/mol): 234.04 InChI Key: SYSZENVIJHPFNL-UHFFFAOYSA-N Synonym: 4-iodoanisole,p-iodoanisole,benzene, 1-iodo-4-methoxy,isoform,4-methoxyiodobenzene,p-methoxyiodobenzene,anisole, p-iodo,4-iodomethoxybenzene,p-iodophenyl methyl ether,1-iodo-4-methoxy-benzene PubChem CID: 69676 IUPAC Name: 1-iodo-4-methoxybenzene SMILES: COC1=CC=C(C=C1)I

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PubChem CID	69676
CAS	696-62-8
Molecular Weight (g/mol)	234.04
SMILES	COC1=CC=C(C=C1)I
Synonym	4-iodoanisole,p-iodoanisole,benzene, 1-iodo-4-methoxy,isoform,4-methoxyiodobenzene,p-methoxyiodobenzene,anisole, p-iodo,4-iodomethoxybenzene,p-iodophenyl methyl ether,1-iodo-4-methoxy-benzene
IUPAC Name	1-iodo-4-methoxybenzene
InChI Key	SYSZENVIJHPFNL-UHFFFAOYSA-N
Molecular Formula	C₇H₇IO

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1-Chloro-3-iodobenzene, 98%

CAS: 625-99-0 Molecular Formula: C6H4ClI Molecular Weight (g/mol): 238.45 MDL Number: MFCD00001046 InChI Key: JMLWXCJXOYDXRN-UHFFFAOYSA-N Synonym: 3-chloroiodobenzene,m-chloroiodobenzene,benzene, 1-chloro-3-iodo,3-iodochlorobenzene,3-chloro-1-iodobenzene,1-chloro-3-iodo-benzene,m-chlorophenyl iodide,m-iodochlorobenzene,metachloroiodobenzene,3-chloro-iodobenzene PubChem CID: 12269 IUPAC Name: 1-chloro-3-iodobenzene SMILES: ClC1=CC=CC(I)=C1

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PubChem CID	12269
CAS	625-99-0
Molecular Weight (g/mol)	238.45
MDL Number	MFCD00001046
SMILES	ClC1=CC=CC(I)=C1
Synonym	3-chloroiodobenzene,m-chloroiodobenzene,benzene, 1-chloro-3-iodo,3-iodochlorobenzene,3-chloro-1-iodobenzene,1-chloro-3-iodo-benzene,m-chlorophenyl iodide,m-iodochlorobenzene,metachloroiodobenzene,3-chloro-iodobenzene
IUPAC Name	1-chloro-3-iodobenzene
InChI Key	JMLWXCJXOYDXRN-UHFFFAOYSA-N
Molecular Formula	C6H4ClI

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2-Bromo-1-chloro-4-iodobenzene, 98%

CAS: 31928-46-8 Molecular Formula: C6H3BrClI Molecular Weight (g/mol): 317.35 MDL Number: MFCD07780667 InChI Key: KSCPVCBJIZDZER-UHFFFAOYSA-N Synonym: 1-bromo-2-chloro-5-iodobenzene,2-bromo-1-chloro-4-iodo-benzene,benzene, 2-bromo-1-chloro-4-iodo,acmc-209hpp,3-bromo-4-chloroiodobenzene,3-bromo-4-chloro-1-iodobenzene,benzene,2-bromo-1-chloro-4-iodo,2-bromanyl-1-chloranyl-4-iodanyl-benzene PubChem CID: 50999503 IUPAC Name: 2-bromo-1-chloro-4-iodobenzene SMILES: ClC1=C(Br)C=C(I)C=C1

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Specifications

PubChem CID	50999503
CAS	31928-46-8
Molecular Weight (g/mol)	317.35
MDL Number	MFCD07780667
SMILES	ClC1=C(Br)C=C(I)C=C1
Synonym	1-bromo-2-chloro-5-iodobenzene,2-bromo-1-chloro-4-iodo-benzene,benzene, 2-bromo-1-chloro-4-iodo,acmc-209hpp,3-bromo-4-chloroiodobenzene,3-bromo-4-chloro-1-iodobenzene,benzene,2-bromo-1-chloro-4-iodo,2-bromanyl-1-chloranyl-4-iodanyl-benzene
IUPAC Name	2-bromo-1-chloro-4-iodobenzene
InChI Key	KSCPVCBJIZDZER-UHFFFAOYSA-N
Molecular Formula	C6H3BrClI

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Diphenyliodonium hexafluorophosphate, 97%, Thermo Scientific Chemicals

CAS: 58109-40-3 Molecular Formula: C12H10I Molecular Weight (g/mol): 281.12 MDL Number: MFCD00061398 InChI Key: OZLBDYMWFAHSOQ-UHFFFAOYSA-N Synonym: diphenyliodonium hexafluorophosphate,diphenyliodanium hexafluorophosphate,diphenyliodonium hexafluorophosphate v,iodonium, diphenyl-, hexafluorophosphate 1-,iodonium, diphenyl-, hexafluorophosphate 1-1:1,diphenyliodonium pf6,dpihfp,acmc-209m2o,phi + pf6-,diphenyliodanium; hexafluoro-$l^ 5-phosphanuide PubChem CID: 2737136 IUPAC Name: diphenyliodanium SMILES: [I+](C1=CC=CC=C1)C1=CC=CC=C1

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Specifications

PubChem CID	2737136
CAS	58109-40-3
Molecular Weight (g/mol)	281.12
MDL Number	MFCD00061398
SMILES	[I+](C1=CC=CC=C1)C1=CC=CC=C1
Synonym	diphenyliodonium hexafluorophosphate,diphenyliodanium hexafluorophosphate,diphenyliodonium hexafluorophosphate v,iodonium, diphenyl-, hexafluorophosphate 1-,iodonium, diphenyl-, hexafluorophosphate 1-1:1,diphenyliodonium pf6,dpihfp,acmc-209m2o,phi + pf6-,diphenyliodanium; hexafluoro-$l^ 5-phosphanuide
IUPAC Name	diphenyliodanium
InChI Key	OZLBDYMWFAHSOQ-UHFFFAOYSA-N
Molecular Formula	C12H10I

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4-Iodophenyl isocyanate, 97%

CAS: 15845-62-2 Molecular Formula: C7H4INO Molecular Weight (g/mol): 245.019 MDL Number: MFCD00013875 InChI Key: KVMKUTIUJGYHBA-UHFFFAOYSA-N Synonym: 4-iodophenyl isocyanate,4-iodophenylisocyanate,1-iodo-4-isocyanato-benzene,p-iodophenylisocyanate,acmc-1bsbj,benzene,1-iodo-4-isocyanato PubChem CID: 3399787 IUPAC Name: 1-iodo-4-isocyanatobenzene SMILES: C1=CC(=CC=C1N=C=O)I

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Specifications

PubChem CID	3399787
CAS	15845-62-2
Molecular Weight (g/mol)	245.019
MDL Number	MFCD00013875
SMILES	C1=CC(=CC=C1N=C=O)I
Synonym	4-iodophenyl isocyanate,4-iodophenylisocyanate,1-iodo-4-isocyanato-benzene,p-iodophenylisocyanate,acmc-1bsbj,benzene,1-iodo-4-isocyanato
IUPAC Name	1-iodo-4-isocyanatobenzene
InChI Key	KVMKUTIUJGYHBA-UHFFFAOYSA-N
Molecular Formula	C7H4INO

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3-Iodoanisole, 98%

CAS: 766-85-8 Molecular Formula: C7H7IO Molecular Weight (g/mol): 234.036 MDL Number: MFCD00001048 InChI Key: RSHBAGGASAJQCH-UHFFFAOYSA-N Synonym: 3-iodoanisole,m-iodoanisole,benzene, 1-iodo-3-methoxy,anisole, m-iodo,m-methoxyiodobenzene,3-methoxyphenyl iodide,3-methoxyiodobenzene,1-iodo-3-methoxy-benzene,m-iodoanisol,m-iodo-anisole PubChem CID: 69839 IUPAC Name: 1-iodo-3-methoxybenzene SMILES: COC1=CC(=CC=C1)I

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Specifications

PubChem CID	69839
CAS	766-85-8
Molecular Weight (g/mol)	234.036
MDL Number	MFCD00001048
SMILES	COC1=CC(=CC=C1)I
Synonym	3-iodoanisole,m-iodoanisole,benzene, 1-iodo-3-methoxy,anisole, m-iodo,m-methoxyiodobenzene,3-methoxyphenyl iodide,3-methoxyiodobenzene,1-iodo-3-methoxy-benzene,m-iodoanisol,m-iodo-anisole
IUPAC Name	1-iodo-3-methoxybenzene
InChI Key	RSHBAGGASAJQCH-UHFFFAOYSA-N
Molecular Formula	C7H7IO

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2-Fluoro-4-iodobenzonitrile, 98%

CAS: 137553-42-5 Molecular Formula: C7H3FIN Molecular Weight (g/mol): 247.011 MDL Number: MFCD03094172 InChI Key: WHQVXHBSTRFRCE-UHFFFAOYSA-N Synonym: 3-fluoro-4-cyano-1-iodobenzene,benzonitrile, 2-fluoro-4-iodo,2-fluoro-4-iodobenzenecarbonitrile,pubchem4778,acmc-209xcp,intermediates-zcf02061,4-iodo-2-fluorobenzonitrile,2-fluoro-4-iodo-benzonitrile,ksc493i5t,benzonitrile,2-fluoro-4-iodo PubChem CID: 2774518 IUPAC Name: 2-fluoro-4-iodobenzonitrile SMILES: C1=CC(=C(C=C1I)F)C#N

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Specifications

PubChem CID	2774518
CAS	137553-42-5
Molecular Weight (g/mol)	247.011
MDL Number	MFCD03094172
SMILES	C1=CC(=C(C=C1I)F)C#N
Synonym	3-fluoro-4-cyano-1-iodobenzene,benzonitrile, 2-fluoro-4-iodo,2-fluoro-4-iodobenzenecarbonitrile,pubchem4778,acmc-209xcp,intermediates-zcf02061,4-iodo-2-fluorobenzonitrile,2-fluoro-4-iodo-benzonitrile,ksc493i5t,benzonitrile,2-fluoro-4-iodo
IUPAC Name	2-fluoro-4-iodobenzonitrile
InChI Key	WHQVXHBSTRFRCE-UHFFFAOYSA-N
Molecular Formula	C7H3FIN

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1-Iodo-3-nitrobenzene, 99%

CAS: 645-00-1 Molecular Formula: C6H4INO2 Molecular Weight (g/mol): 249.007 MDL Number: MFCD00007218 InChI Key: CBYAZOKPJYBCHE-UHFFFAOYSA-N Synonym: 3-iodonitrobenzene,m-iodonitrobenzene,benzene, 1-iodo-3-nitro,3-nitroiodobenzene,meta-iodonitrobenzene,3-i-nitrobenzene,iodo-3-nitrobenzene,meta-nitroiodobenzene,1-iodo-3-nitro-benzene,3-nitro-iodobenzen PubChem CID: 12574 ChEBI: CHEBI:67123 IUPAC Name: 1-iodo-3-nitrobenzene SMILES: C1=CC(=CC(=C1)I)[N+](=O)[O-]

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Specifications

PubChem CID	12574
CAS	645-00-1
Molecular Weight (g/mol)	249.007
ChEBI	CHEBI:67123
MDL Number	MFCD00007218
SMILES	C1=CC(=CC(=C1)I)[N+](=O)[O-]
Synonym	3-iodonitrobenzene,m-iodonitrobenzene,benzene, 1-iodo-3-nitro,3-nitroiodobenzene,meta-iodonitrobenzene,3-i-nitrobenzene,iodo-3-nitrobenzene,meta-nitroiodobenzene,1-iodo-3-nitro-benzene,3-nitro-iodobenzen
IUPAC Name	1-iodo-3-nitrobenzene
InChI Key	CBYAZOKPJYBCHE-UHFFFAOYSA-N
Molecular Formula	C6H4INO2

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1-Iodo-2,4-dimethoxybenzene, 97%

CAS: 20469-63-0 Molecular Formula: C8H9IO2 Molecular Weight (g/mol): 264.062 MDL Number: MFCD00059268 InChI Key: ZDUYJCKEORTAQE-UHFFFAOYSA-N Synonym: 2,4-dimethoxyiodobenzene,2,4-dimethoxy-1-iodobenzene,1,3-dimethoxy-4-iodobenzene,1-iodo-2,4-dimethoxy-benzene,benzene, 1-iodo-2,4-dimethoxy,4-iodo-1,3-dimethoxybenzene,pubchem3053,4-iodo-3-methoxy anisole,dimethoxyiodobenzene,cambridge id 5107587 PubChem CID: 140694 IUPAC Name: 1-iodo-2,4-dimethoxybenzene SMILES: COC1=CC(=C(C=C1)I)OC

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Specifications

PubChem CID	140694
CAS	20469-63-0
Molecular Weight (g/mol)	264.062
MDL Number	MFCD00059268
SMILES	COC1=CC(=C(C=C1)I)OC
Synonym	2,4-dimethoxyiodobenzene,2,4-dimethoxy-1-iodobenzene,1,3-dimethoxy-4-iodobenzene,1-iodo-2,4-dimethoxy-benzene,benzene, 1-iodo-2,4-dimethoxy,4-iodo-1,3-dimethoxybenzene,pubchem3053,4-iodo-3-methoxy anisole,dimethoxyiodobenzene,cambridge id 5107587
IUPAC Name	1-iodo-2,4-dimethoxybenzene
InChI Key	ZDUYJCKEORTAQE-UHFFFAOYSA-N
Molecular Formula	C8H9IO2

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4-Iodoaniline, 99%

CAS: 540-37-4 Molecular Formula: C₆H₆IN Molecular Weight (g/mol): 219.02 InChI Key: VLVCDUSVTXIWGW-UHFFFAOYSA-N Synonym: p-iodoaniline,benzenamine, 4-iodo,4-iodobenzenamine,aniline, p-iodo,p-aminophenyl iodide,aniline, 4-iodo,4-iodo-aniline,4-iodophenylamine,4-iodo-benzenamine,4-iodo-phenylamine PubChem CID: 10893 IUPAC Name: 4-iodoaniline SMILES: C1=CC(=CC=C1N)I

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Specifications

PubChem CID	10893
CAS	540-37-4
Molecular Weight (g/mol)	219.02
SMILES	C1=CC(=CC=C1N)I
Synonym	p-iodoaniline,benzenamine, 4-iodo,4-iodobenzenamine,aniline, p-iodo,p-aminophenyl iodide,aniline, 4-iodo,4-iodo-aniline,4-iodophenylamine,4-iodo-benzenamine,4-iodo-phenylamine
IUPAC Name	4-iodoaniline
InChI Key	VLVCDUSVTXIWGW-UHFFFAOYSA-N
Molecular Formula	C₆H₆IN

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1-n-Heptyl-4-iodobenzene, 98%

CAS: 131894-91-2 Molecular Formula: C13H19I Molecular Weight (g/mol): 302.20 MDL Number: MFCD07777084 InChI Key: NHXKOPSTJPLWPK-UHFFFAOYSA-N Synonym: 1-n-heptyl-4-iodobenzene,4-heptyl-1-iodobenzene PubChem CID: 15001646 IUPAC Name: 1-heptyl-4-iodobenzene SMILES: CCCCCCCC1=CC=C(I)C=C1

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Specifications

PubChem CID	15001646
CAS	131894-91-2
Molecular Weight (g/mol)	302.20
MDL Number	MFCD07777084
SMILES	CCCCCCCC1=CC=C(I)C=C1
Synonym	1-n-heptyl-4-iodobenzene,4-heptyl-1-iodobenzene
IUPAC Name	1-heptyl-4-iodobenzene
InChI Key	NHXKOPSTJPLWPK-UHFFFAOYSA-N
Molecular Formula	C13H19I

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4-Bromo-2-iodoaniline, 97%

CAS: 66416-72-6 Molecular Formula: C₆H₅BrIN Molecular Weight (g/mol): 297.91 MDL Number: MFCD02093764 InChI Key: HHTYEQWCHQEJNV-UHFFFAOYSA-N Synonym: 4-bromo-2-iodo-phenylamine,4-bromo-2-iodobenzenamine,2-iodo-4-bromoaniline,benzenamine,4-bromo-2-iodo,benzenamine, 4-bromo-2-iodo,pubchem3784,acmc-1b9hb,4-bromo-2-iodophenylamine,asischem t54343,4-bromo-2-iodo-benzenamine PubChem CID: 823934 IUPAC Name: 4-bromo-2-iodoaniline SMILES: C1=CC(=C(C=C1Br)I)N

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Specifications

PubChem CID	823934
CAS	66416-72-6
Molecular Weight (g/mol)	297.91
MDL Number	MFCD02093764
SMILES	C1=CC(=C(C=C1Br)I)N
Synonym	4-bromo-2-iodo-phenylamine,4-bromo-2-iodobenzenamine,2-iodo-4-bromoaniline,benzenamine,4-bromo-2-iodo,benzenamine, 4-bromo-2-iodo,pubchem3784,acmc-1b9hb,4-bromo-2-iodophenylamine,asischem t54343,4-bromo-2-iodo-benzenamine
IUPAC Name	4-bromo-2-iodoaniline
InChI Key	HHTYEQWCHQEJNV-UHFFFAOYSA-N
Molecular Formula	C₆H₅BrIN

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[Bis(trifluoroacetoxy)iodo]benzene, 97%

CAS: 2712-78-9 Molecular Formula: C10H5F6IO4 Molecular Weight (g/mol): 430.041 MDL Number: MFCD00009672 InChI Key: PEZNEXFPRSOYPL-UHFFFAOYSA-N Synonym: bis trifluoroacetoxy iodo benzene,pifa,unii-659sfv27xs,bis-trifluoroacetoxyiodobenzene,phenylbis trifluoroacetato-o iodine,bis i,i-trifluoroacetoxy iodobenzene,iodine, phenylbis trifluoroacetato-o,bis trifluoracetoxy-iodobenzene,bis trifluoroacetoxy phenyl iodane PubChem CID: 102317 IUPAC Name: [phenyl-(2,2,2-trifluoroacetyl)oxy-$l^{3}-iodanyl] 2,2,2-trifluoroacetate SMILES: C1=CC=C(C=C1)I(OC(=O)C(F)(F)F)OC(=O)C(F)(F)F

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Specifications

PubChem CID	102317
CAS	2712-78-9
Molecular Weight (g/mol)	430.041
MDL Number	MFCD00009672
SMILES	C1=CC=C(C=C1)I(OC(=O)C(F)(F)F)OC(=O)C(F)(F)F
Synonym	bis trifluoroacetoxy iodo benzene,pifa,unii-659sfv27xs,bis-trifluoroacetoxyiodobenzene,phenylbis trifluoroacetato-o iodine,bis i,i-trifluoroacetoxy iodobenzene,iodine, phenylbis trifluoroacetato-o,bis trifluoracetoxy-iodobenzene,bis trifluoroacetoxy phenyl iodane
IUPAC Name	[phenyl-(2,2,2-trifluoroacetyl)oxy-$l^{3}-iodanyl] 2,2,2-trifluoroacetate
InChI Key	PEZNEXFPRSOYPL-UHFFFAOYSA-N
Molecular Formula	C10H5F6IO4

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