Benzene and substituted derivatives

Benzene is an aromatic organic molecule composed of six carbon atoms and six hydrogen atoms that form a ring. Includes substituted derivative compounds.

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3,271 – 3,285 of 57,266 results

3,271

3-Iodotoluene, 99%

CAS: 625-95-6 Molecular Formula: C7H7I Molecular Weight (g/mol): 218.037 MDL Number: MFCD00001050 InChI Key: VLCPISYURGTGLP-UHFFFAOYSA-N Synonym: 3-iodotoluene,m-iodotoluene,benzene, 1-iodo-3-methyl,m-tolyl iodide,m-methyliodobenzene,toluene, m-iodo,3-methylphenyl iodide,unii-2h574ir35g,1-iodo-3-methyl-benzene,m-iodo-toluen PubChem CID: 12268 IUPAC Name: 1-iodo-3-methylbenzene SMILES: CC1=CC(=CC=C1)I

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Specifications

PubChem CID	12268
CAS	625-95-6
Molecular Weight (g/mol)	218.037
MDL Number	MFCD00001050
SMILES	CC1=CC(=CC=C1)I
Synonym	3-iodotoluene,m-iodotoluene,benzene, 1-iodo-3-methyl,m-tolyl iodide,m-methyliodobenzene,toluene, m-iodo,3-methylphenyl iodide,unii-2h574ir35g,1-iodo-3-methyl-benzene,m-iodo-toluen
IUPAC Name	1-iodo-3-methylbenzene
InChI Key	VLCPISYURGTGLP-UHFFFAOYSA-N
Molecular Formula	C7H7I

3,272

2-Iodotoluene, 98%

CAS: 615-37-2 Molecular Formula: C₇H₇I Molecular Weight (g/mol): 218.04 MDL Number: MFCD00001042 InChI Key: RINOYHWVBUKAQE-UHFFFAOYSA-N Synonym: 2-iodotoluene,o-iodotoluene,o-tolyl iodide,benzene, 1-iodo-2-methyl,o-methyliodobenzene,toluene, o-iodo,iodotoluene,ortho-iodotoluene,2-methyliodobenzene,unii-8ok4h85t07 PubChem CID: 5128 ChEBI: CHEBI:39813 IUPAC Name: 1-iodo-2-methylbenzene SMILES: CC1=CC=CC=C1I

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Specifications

PubChem CID	5128
CAS	615-37-2
Molecular Weight (g/mol)	218.04
ChEBI	CHEBI:39813
MDL Number	MFCD00001042
SMILES	CC1=CC=CC=C1I
Synonym	2-iodotoluene,o-iodotoluene,o-tolyl iodide,benzene, 1-iodo-2-methyl,o-methyliodobenzene,toluene, o-iodo,iodotoluene,ortho-iodotoluene,2-methyliodobenzene,unii-8ok4h85t07
IUPAC Name	1-iodo-2-methylbenzene
InChI Key	RINOYHWVBUKAQE-UHFFFAOYSA-N
Molecular Formula	C₇H₇I

3,273

1,2-Difluoro-4-iodobenzene, 99%

CAS: 64248-58-4 Molecular Formula: C6H3F2I Molecular Weight (g/mol): 239.99 MDL Number: MFCD00044630 InChI Key: KSASJELKLBIMSG-UHFFFAOYSA-N Synonym: 3,4-difluoroiodobenzene,1,2-difluoro-4-iodo-benzene,benzene, 1,2-difluoro-4-iodo,3,4-difluoro iodobenzene,pubchem3461,3,4-difluoro-iodobenzene,3,4-difluorophenyl iodide,3,4-difluoro-1-iodobenzene,1-iodo-3,4-difluoro-benzene PubChem CID: 2724444 IUPAC Name: 1,2-difluoro-4-iodobenzene SMILES: FC1=C(F)C=C(I)C=C1

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Specifications

PubChem CID	2724444
CAS	64248-58-4
Molecular Weight (g/mol)	239.99
MDL Number	MFCD00044630
SMILES	FC1=C(F)C=C(I)C=C1
Synonym	3,4-difluoroiodobenzene,1,2-difluoro-4-iodo-benzene,benzene, 1,2-difluoro-4-iodo,3,4-difluoro iodobenzene,pubchem3461,3,4-difluoro-iodobenzene,3,4-difluorophenyl iodide,3,4-difluoro-1-iodobenzene,1-iodo-3,4-difluoro-benzene
IUPAC Name	1,2-difluoro-4-iodobenzene
InChI Key	KSASJELKLBIMSG-UHFFFAOYSA-N
Molecular Formula	C6H3F2I

3,274

4-Iodobenzonitrile, 98%

CAS: 3058-39-7 Molecular Formula: C7H4IN Molecular Weight (g/mol): 229.02 MDL Number: MFCD00051310 InChI Key: XOKDXPVXJWTSRM-UHFFFAOYSA-N Synonym: p-iodobenzonitrile,benzonitrile, 4-iodo,p-cyanoiodobenzene,benzonitrile, p-iodo,1-cyano-4-iodobenzene,4-cyanoiodobenzene,4-iodo-benzonitrile,4-iodobenzenecarbonitrile,4-iodbenzonitril,4-iodo benzonitrile PubChem CID: 76467 IUPAC Name: 4-iodobenzonitrile SMILES: IC1=CC=C(C=C1)C#N

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Specifications

PubChem CID	76467
CAS	3058-39-7
Molecular Weight (g/mol)	229.02
MDL Number	MFCD00051310
SMILES	IC1=CC=C(C=C1)C#N
Synonym	p-iodobenzonitrile,benzonitrile, 4-iodo,p-cyanoiodobenzene,benzonitrile, p-iodo,1-cyano-4-iodobenzene,4-cyanoiodobenzene,4-iodo-benzonitrile,4-iodobenzenecarbonitrile,4-iodbenzonitril,4-iodo benzonitrile
IUPAC Name	4-iodobenzonitrile
InChI Key	XOKDXPVXJWTSRM-UHFFFAOYSA-N
Molecular Formula	C7H4IN

3,275

1-Bromo-2-iodobenzene, 99%, stabilized

CAS: 583-55-1 Molecular Formula: C₆H₄BrI Molecular Weight (g/mol): 282.9 MDL Number: MFCD00001030 InChI Key: OIRHKGBNGGSCGS-UHFFFAOYSA-N Synonym: 2-bromoiodobenzene,o-bromoiodobenzene,2-bromo-iodobenzene,benzene, 1-bromo-2-iodo,bromoiodobenzene,1-bromo-2-iodo-benzene,attercop-chm at127403,chemwish ic03500,iodobromobenzene,2-iodobromobenzene PubChem CID: 11415 IUPAC Name: 1-bromo-2-iodobenzene SMILES: C1=CC=C(C(=C1)Br)I

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Specifications

PubChem CID	11415
CAS	583-55-1
Molecular Weight (g/mol)	282.9
MDL Number	MFCD00001030
SMILES	C1=CC=C(C(=C1)Br)I
Synonym	2-bromoiodobenzene,o-bromoiodobenzene,2-bromo-iodobenzene,benzene, 1-bromo-2-iodo,bromoiodobenzene,1-bromo-2-iodo-benzene,attercop-chm at127403,chemwish ic03500,iodobromobenzene,2-iodobromobenzene
IUPAC Name	1-bromo-2-iodobenzene
InChI Key	OIRHKGBNGGSCGS-UHFFFAOYSA-N
Molecular Formula	C₆H₄BrI

3,276

1-Chloro-2-iodobenzene, 99%

CAS: 615-41-8 Molecular Formula: C6H4ClI Molecular Weight (g/mol): 238.45 MDL Number: MFCD00001033 InChI Key: MPEOPBCQHNWNFB-UHFFFAOYSA-N Synonym: 2-chloroiodobenzene,o-chloroiodobenzene,o-iodochlorobenzene,2-iodochlorobenzene,benzene, 1-chloro-2-iodo,2-chlorophenyl iodide,2-chloro-1-iodobenzene,1-chloro-2-iodo-benzene,chlorjodbenzol,iodochlorobenzene PubChem CID: 11993 IUPAC Name: 1-chloro-2-iodobenzene SMILES: ClC1=CC=CC=C1I

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Specifications

PubChem CID	11993
CAS	615-41-8
Molecular Weight (g/mol)	238.45
MDL Number	MFCD00001033
SMILES	ClC1=CC=CC=C1I
Synonym	2-chloroiodobenzene,o-chloroiodobenzene,o-iodochlorobenzene,2-iodochlorobenzene,benzene, 1-chloro-2-iodo,2-chlorophenyl iodide,2-chloro-1-iodobenzene,1-chloro-2-iodo-benzene,chlorjodbenzol,iodochlorobenzene
IUPAC Name	1-chloro-2-iodobenzene
InChI Key	MPEOPBCQHNWNFB-UHFFFAOYSA-N
Molecular Formula	C6H4ClI

3,277

4-Fluoro-2-iodoaniline, 96%

CAS: 61272-76-2 Molecular Formula: C6H5FIN Molecular Weight (g/mol): 237.02 MDL Number: MFCD00042584 InChI Key: SETOTRGVPANENO-UHFFFAOYSA-N Synonym: 2-iodo-4-fluoroaniline,4-fluoro-2-indoaniline,4-fluoro-2-iodoanline,4-fluoro-2-iodo-aniline,4-fluoro-2-iodophenylamine,4-fluoro-2-iodo-phenylamine,benzenamine, 4-fluoro-2-iodo,zlchem 368,pubchem3413,2-iodo-4-fluoro-aniline PubChem CID: 2778283 IUPAC Name: 4-fluoro-2-iodoaniline SMILES: NC1=C(I)C=C(F)C=C1

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Specifications

PubChem CID	2778283
CAS	61272-76-2
Molecular Weight (g/mol)	237.02
MDL Number	MFCD00042584
SMILES	NC1=C(I)C=C(F)C=C1
Synonym	2-iodo-4-fluoroaniline,4-fluoro-2-indoaniline,4-fluoro-2-iodoanline,4-fluoro-2-iodo-aniline,4-fluoro-2-iodophenylamine,4-fluoro-2-iodo-phenylamine,benzenamine, 4-fluoro-2-iodo,zlchem 368,pubchem3413,2-iodo-4-fluoro-aniline
IUPAC Name	4-fluoro-2-iodoaniline
InChI Key	SETOTRGVPANENO-UHFFFAOYSA-N
Molecular Formula	C6H5FIN

3,278

4-Amino-3-iodobenzonitrile, 97%

CAS: 33348-34-4 Molecular Formula: C7H5IN2 Molecular Weight (g/mol): 244.035 MDL Number: MFCD04039964 InChI Key: UOWVTQFTEAYDLM-UHFFFAOYSA-N Synonym: 4-cyano-2-iodoaniline,1-amino-2-iodo-4-cyanobenzene,benzonitrile, 4-amino-3-iodo,4-amino-2-iodobenzonitrile 98,4-amino-3-iodobenzenecarbonitrile,2-iodo-4-cyanoaniline,4-cyano-6-iodoaniline,pubchem18486,acmc-20a6lw,3-iodo-4-aminobenzonitrile PubChem CID: 4416395 IUPAC Name: 4-amino-3-iodobenzonitrile SMILES: C1=CC(=C(C=C1C#N)I)N

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Specifications

PubChem CID	4416395
CAS	33348-34-4
Molecular Weight (g/mol)	244.035
MDL Number	MFCD04039964
SMILES	C1=CC(=C(C=C1C#N)I)N
Synonym	4-cyano-2-iodoaniline,1-amino-2-iodo-4-cyanobenzene,benzonitrile, 4-amino-3-iodo,4-amino-2-iodobenzonitrile 98,4-amino-3-iodobenzenecarbonitrile,2-iodo-4-cyanoaniline,4-cyano-6-iodoaniline,pubchem18486,acmc-20a6lw,3-iodo-4-aminobenzonitrile
IUPAC Name	4-amino-3-iodobenzonitrile
InChI Key	UOWVTQFTEAYDLM-UHFFFAOYSA-N
Molecular Formula	C7H5IN2

3,279

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

3,280

1-(2-Iodobenzyl)-1H-1,2,4-triazole, 97%, Thermo Scientific™

CAS: 876316-31-3 Molecular Formula: C9H8IN3 Molecular Weight (g/mol): 285.09 MDL Number: MFCD08741431 InChI Key: NDJIYFFWZVACMJ-UHFFFAOYSA-N Synonym: 1-2-iodobenzyl-1h-1,2,4-triazole,1-2-iodophenyl methyl-1,2,4-triazole,1-2-iodophenyl methyl-1h-1,2,4-triazole,1h-1,2,4-triazole,1-2-iodophenyl methyl,1-2-iodobenzyl-1h-1,2,4 triazole PubChem CID: 18525817 IUPAC Name: 1-[(2-iodophenyl)methyl]-1,2,4-triazole SMILES: IC1=CC=CC=C1CN1C=NC=N1

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Specifications

PubChem CID	18525817
CAS	876316-31-3
Molecular Weight (g/mol)	285.09
MDL Number	MFCD08741431
SMILES	IC1=CC=CC=C1CN1C=NC=N1
Synonym	1-2-iodobenzyl-1h-1,2,4-triazole,1-2-iodophenyl methyl-1,2,4-triazole,1-2-iodophenyl methyl-1h-1,2,4-triazole,1h-1,2,4-triazole,1-2-iodophenyl methyl,1-2-iodobenzyl-1h-1,2,4 triazole
IUPAC Name	1-[(2-iodophenyl)methyl]-1,2,4-triazole
InChI Key	NDJIYFFWZVACMJ-UHFFFAOYSA-N
Molecular Formula	C9H8IN3

3,281

1-Iodo-2-nitrobenzene, 97%, Thermo Scientific Chemicals

CAS: 609-73-4 Molecular Formula: C6H4INO2 Molecular Weight (g/mol): 249.01 MDL Number: MFCD00007088 InChI Key: JXMZUNPWVXQADG-UHFFFAOYSA-N Synonym: 2-iodonitrobenzene,o-iodonitrobenzene,o-nitroiodobenzene,benzene, 1-iodo-2-nitro,2-nitroiodobenzene,2-iodo-1-nitrobenzene,1-iodo-2-nitro-benzene,2-iodo-nitrobenzene,2-nitro-iodobenzene,benzene, iodonitro PubChem CID: 69115 IUPAC Name: 1-iodo-2-nitrobenzene SMILES: [O-][N+](=O)C1=CC=CC=C1I

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Specifications

PubChem CID	69115
CAS	609-73-4
Molecular Weight (g/mol)	249.01
MDL Number	MFCD00007088
SMILES	[O-][N+](=O)C1=CC=CC=C1I
Synonym	2-iodonitrobenzene,o-iodonitrobenzene,o-nitroiodobenzene,benzene, 1-iodo-2-nitro,2-nitroiodobenzene,2-iodo-1-nitrobenzene,1-iodo-2-nitro-benzene,2-iodo-nitrobenzene,2-nitro-iodobenzene,benzene, iodonitro
IUPAC Name	1-iodo-2-nitrobenzene
InChI Key	JXMZUNPWVXQADG-UHFFFAOYSA-N
Molecular Formula	C6H4INO2

3,282

4-Chloro-2-fluoro-1-iodobenzene, 98%

CAS: 6797-79-1 Molecular Formula: C6H3ClFI Molecular Weight (g/mol): 256.44 MDL Number: MFCD00079729 InChI Key: RSTFBOIFYXJIMR-UHFFFAOYSA-N Synonym: 4-chloro-2-fluoroiodobenzene,2-fluoro-4-chloroiodobenzene,1-chloro-3-fluoro-4-iodobenzene,4-chloro-2-fluoro-1-iodo-benzene,4-chloro-2-fluoro-iodobenzene,pubchem3435,acmc-1b71k,2-iodo-5-chlorofluorobenzene,2-iodo-5-chlorofluoro benzene,3-fluoro-4-iodophenyl chloride PubChem CID: 2736562 IUPAC Name: 4-chloro-2-fluoro-1-iodobenzene SMILES: FC1=C(I)C=CC(Cl)=C1

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Specifications

PubChem CID	2736562
CAS	6797-79-1
Molecular Weight (g/mol)	256.44
MDL Number	MFCD00079729
SMILES	FC1=C(I)C=CC(Cl)=C1
Synonym	4-chloro-2-fluoroiodobenzene,2-fluoro-4-chloroiodobenzene,1-chloro-3-fluoro-4-iodobenzene,4-chloro-2-fluoro-1-iodo-benzene,4-chloro-2-fluoro-iodobenzene,pubchem3435,acmc-1b71k,2-iodo-5-chlorofluorobenzene,2-iodo-5-chlorofluoro benzene,3-fluoro-4-iodophenyl chloride
IUPAC Name	4-chloro-2-fluoro-1-iodobenzene
InChI Key	RSTFBOIFYXJIMR-UHFFFAOYSA-N
Molecular Formula	C6H3ClFI

3,283

3-Iodoanisole, 97%

CAS: 766-85-8 Molecular Formula: C₇H₇IO Molecular Weight (g/mol): 234.04 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)	234.04
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

3,284

1-Benzyloxy-4-iodobenzene, 98+%

CAS: 19578-68-8 Molecular Formula: C13H11IO Molecular Weight (g/mol): 310.134 MDL Number: MFCD00079704 InChI Key: MPWFGAWFTAZWKZ-UHFFFAOYSA-N PubChem CID: 519671 IUPAC Name: 1-iodo-4-phenylmethoxybenzene SMILES: C1=CC=C(C=C1)COC2=CC=C(C=C2)I

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Specifications

PubChem CID	519671
CAS	19578-68-8
Molecular Weight (g/mol)	310.134
MDL Number	MFCD00079704
SMILES	C1=CC=C(C=C1)COC2=CC=C(C=C2)I
IUPAC Name	1-iodo-4-phenylmethoxybenzene
InChI Key	MPWFGAWFTAZWKZ-UHFFFAOYSA-N
Molecular Formula	C13H11IO

3,285

5-Bromo-2-iodobenzonitrile, 98+%

CAS: 121554-10-7 Molecular Formula: C7H3BrIN Molecular Weight (g/mol): 307.916 MDL Number: MFCD00672950 InChI Key: JIGKPMMZNMQXDL-UHFFFAOYSA-N PubChem CID: 7020874 IUPAC Name: 5-bromo-2-iodobenzonitrile SMILES: C1=CC(=C(C=C1Br)C#N)I

Pricing & Availability
Specifications

PubChem CID	7020874
CAS	121554-10-7
Molecular Weight (g/mol)	307.916
MDL Number	MFCD00672950
SMILES	C1=CC(=C(C=C1Br)C#N)I
IUPAC Name	5-bromo-2-iodobenzonitrile
InChI Key	JIGKPMMZNMQXDL-UHFFFAOYSA-N
Molecular Formula	C7H3BrIN

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