Benzene and substituted derivatives
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1-Fluoro-3-iodo-5-nitrobenzene, 98%, Thermo Scientific™
CAS: 3819-88-3 Molecular Formula: C6H3FINO2 Molecular Weight (g/mol): 266.99 MDL Number: MFCD00007219 InChI Key: MXPYCSFCKXSPAB-UHFFFAOYSA-N Synonym: 3-fluoro-5-iodonitrobenzene,benzene, 1-fluoro-3-iodo-5-nitro,acmc-1cr1w,5-fluoro-3-nitroiodobenzene,ksc495i2h,1-iodo-3-fluoro-5-nitrobenzene,1-fluoro-3-iodo-5-nitro-benzene,1-fluoro-3-iodo-5-nitrobenzene PubChem CID: 259086 IUPAC Name: 1-fluoro-3-iodo-5-nitrobenzene SMILES: C1=C(C=C(C=C1F)I)[N+](=O)[O-]
| PubChem CID | 259086 |
|---|---|
| CAS | 3819-88-3 |
| Molecular Weight (g/mol) | 266.99 |
| MDL Number | MFCD00007219 |
| SMILES | C1=C(C=C(C=C1F)I)[N+](=O)[O-] |
| Synonym | 3-fluoro-5-iodonitrobenzene,benzene, 1-fluoro-3-iodo-5-nitro,acmc-1cr1w,5-fluoro-3-nitroiodobenzene,ksc495i2h,1-iodo-3-fluoro-5-nitrobenzene,1-fluoro-3-iodo-5-nitro-benzene,1-fluoro-3-iodo-5-nitrobenzene |
| IUPAC Name | 1-fluoro-3-iodo-5-nitrobenzene |
| InChI Key | MXPYCSFCKXSPAB-UHFFFAOYSA-N |
| Molecular Formula | C6H3FINO2 |
1,4-Diiodobenzene, 98%
CAS: 624-38-4 Molecular Formula: C6H4I2 Molecular Weight (g/mol): 329.9 MDL Number: MFCD00001054 InChI Key: LFMWZTSOMGDDJU-UHFFFAOYSA-N Synonym: p-diiodobenzene,benzene, 1,4-diiodo,p-benzene diiodide,benzene, p-diiodo,unii-i9xcf83vav,i9xcf83vav,1,4-diiodbenzene,1,4-diidobenzene,1,4 diiodobenzene,1,4-diiodiobenzene PubChem CID: 12208 IUPAC Name: 1,4-diiodobenzene SMILES: C1=CC(=CC=C1I)I
| PubChem CID | 12208 |
|---|---|
| CAS | 624-38-4 |
| Molecular Weight (g/mol) | 329.9 |
| MDL Number | MFCD00001054 |
| SMILES | C1=CC(=CC=C1I)I |
| Synonym | p-diiodobenzene,benzene, 1,4-diiodo,p-benzene diiodide,benzene, p-diiodo,unii-i9xcf83vav,i9xcf83vav,1,4-diiodbenzene,1,4-diidobenzene,1,4 diiodobenzene,1,4-diiodiobenzene |
| IUPAC Name | 1,4-diiodobenzene |
| InChI Key | LFMWZTSOMGDDJU-UHFFFAOYSA-N |
| Molecular Formula | C6H4I2 |
3-Iodoaniline, 98%
CAS: 626-01-7 Molecular Formula: C6H6IN Molecular Weight (g/mol): 219.025 MDL Number: MFCD00007781 InChI Key: FFCSRWGYGMRBGD-UHFFFAOYSA-N Synonym: m-iodoaniline,benzenamine, 3-iodo,aniline, m-iodo,m-aminoiodobenzene,3-iodobenzenamine,1-amino-3-iodobenzene,3-iodo-phenylamine,3iodoaniline,3-iodo-aniline,3-iodophenylamine PubChem CID: 12271 IUPAC Name: 3-iodoaniline SMILES: C1=CC(=CC(=C1)I)N
| PubChem CID | 12271 |
|---|---|
| CAS | 626-01-7 |
| Molecular Weight (g/mol) | 219.025 |
| MDL Number | MFCD00007781 |
| SMILES | C1=CC(=CC(=C1)I)N |
| Synonym | m-iodoaniline,benzenamine, 3-iodo,aniline, m-iodo,m-aminoiodobenzene,3-iodobenzenamine,1-amino-3-iodobenzene,3-iodo-phenylamine,3iodoaniline,3-iodo-aniline,3-iodophenylamine |
| IUPAC Name | 3-iodoaniline |
| InChI Key | FFCSRWGYGMRBGD-UHFFFAOYSA-N |
| Molecular Formula | C6H6IN |
Potassium 4-iodophenyltrifluoroborate, 96%
CAS: 912350-00-6 Molecular Formula: C6H4BF3IK Molecular Weight (g/mol): 309.906 MDL Number: MFCD09800738 InChI Key: WTXNSBOVCAXUGV-UHFFFAOYSA-N Synonym: potassium 4-iodophenyltrifluoroborate,potassium trifluoro 4-iodophenyl boranuide,amtb080,potassium trifluoro 4-iodophenyl borate 1- PubChem CID: 23688160 IUPAC Name: potassium;trifluoro-(4-iodophenyl)boranuide SMILES: [B-](C1=CC=C(C=C1)I)(F)(F)F.[K+]
| PubChem CID | 23688160 |
|---|---|
| CAS | 912350-00-6 |
| Molecular Weight (g/mol) | 309.906 |
| MDL Number | MFCD09800738 |
| SMILES | [B-](C1=CC=C(C=C1)I)(F)(F)F.[K+] |
| Synonym | potassium 4-iodophenyltrifluoroborate,potassium trifluoro 4-iodophenyl boranuide,amtb080,potassium trifluoro 4-iodophenyl borate 1- |
| IUPAC Name | potassium;trifluoro-(4-iodophenyl)boranuide |
| InChI Key | WTXNSBOVCAXUGV-UHFFFAOYSA-N |
| Molecular Formula | C6H4BF3IK |
2,4-Dichloro-6-iodoaniline, 97%
CAS: 697-90-5 Molecular Formula: C6H4Cl2IN Molecular Weight (g/mol): 287.909 MDL Number: MFCD00007661 InChI Key: YJRSMJTVXWBFJJ-UHFFFAOYSA-N Synonym: 2,4-dichloro-6-iodobenzenamine,2,4-dichloro-6-iodophenylamine,4,6-dichloro-2-iodophenylamine,2,4-dichloro-6-iodo-phenylamine,benzenamine,2,4-dichloro-6-iodo,benzenamine, 2,4-dichloro-6-iodo,1-amino-2,4-dichloro-6-iodobenzene PubChem CID: 7577525 IUPAC Name: 2,4-dichloro-6-iodoaniline SMILES: C1=C(C=C(C(=C1Cl)N)I)Cl
| PubChem CID | 7577525 |
|---|---|
| CAS | 697-90-5 |
| Molecular Weight (g/mol) | 287.909 |
| MDL Number | MFCD00007661 |
| SMILES | C1=C(C=C(C(=C1Cl)N)I)Cl |
| Synonym | 2,4-dichloro-6-iodobenzenamine,2,4-dichloro-6-iodophenylamine,4,6-dichloro-2-iodophenylamine,2,4-dichloro-6-iodo-phenylamine,benzenamine,2,4-dichloro-6-iodo,benzenamine, 2,4-dichloro-6-iodo,1-amino-2,4-dichloro-6-iodobenzene |
| IUPAC Name | 2,4-dichloro-6-iodoaniline |
| InChI Key | YJRSMJTVXWBFJJ-UHFFFAOYSA-N |
| Molecular Formula | C6H4Cl2IN |
4-Iodobenzonitrile, 99%, Thermo Scientific Chemicals
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
| 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 |
2-Iodobenzonitrile, 99%
CAS: 4387-36-4 Molecular Weight (g/mol): 229.02 MDL Number: MFCD00079761 InChI Key: JDDAFHUEOVUDFJ-UHFFFAOYSA-N Synonym: 1-cyano-2-iodobenzene,benzonitrile, 2-iodo,o-iodobenzonitrile,2-iodobenzenecarbonitrile,iodobenzonitrile,2-cyanoiodobenzene,pubchem3932,acmc-209jvq,2-iodobenzonitrile,ksc235m8d PubChem CID: 2759358 IUPAC Name: 2-iodobenzonitrile SMILES: C1=CC=C(C(=C1)C#N)I
| PubChem CID | 2759358 |
|---|---|
| CAS | 4387-36-4 |
| Molecular Weight (g/mol) | 229.02 |
| MDL Number | MFCD00079761 |
| SMILES | C1=CC=C(C(=C1)C#N)I |
| Synonym | 1-cyano-2-iodobenzene,benzonitrile, 2-iodo,o-iodobenzonitrile,2-iodobenzenecarbonitrile,iodobenzonitrile,2-cyanoiodobenzene,pubchem3932,acmc-209jvq,2-iodobenzonitrile,ksc235m8d |
| IUPAC Name | 2-iodobenzonitrile |
| InChI Key | JDDAFHUEOVUDFJ-UHFFFAOYSA-N |
Diphenyliodonium trifluoromethanesulfonate, 99%
CAS: 66003-76-7 Molecular Formula: C13H10F3IO3S Molecular Weight (g/mol): 430.18 MDL Number: MFCD00191356 InChI Key: SBQIJPBUMNWUKN-UHFFFAOYSA-M Synonym: diphenyliodonium trifluoromethanesulfonate,diphenyliodanium triflate,diphenyliodonium triflate,acmc-209nt6,diphenyliodonium trifluoromethansulfonat,diphenyliodanium; trifluoromethanesulfonate,diphenyliodonium trifluoromethane sulfonate,diphenyliodonium; trifluoromethanesulfonate,diphenyliodanium; tris fluoranyl methanesulfonate PubChem CID: 2737137 IUPAC Name: diphenyliodanium;trifluoromethanesulfonate SMILES: C1=CC=C(C=C1)[I+]C2=CC=CC=C2.C(F)(F)(F)S(=O)(=O)[O-]
| PubChem CID | 2737137 |
|---|---|
| CAS | 66003-76-7 |
| Molecular Weight (g/mol) | 430.18 |
| MDL Number | MFCD00191356 |
| SMILES | C1=CC=C(C=C1)[I+]C2=CC=CC=C2.C(F)(F)(F)S(=O)(=O)[O-] |
| Synonym | diphenyliodonium trifluoromethanesulfonate,diphenyliodanium triflate,diphenyliodonium triflate,acmc-209nt6,diphenyliodonium trifluoromethansulfonat,diphenyliodanium; trifluoromethanesulfonate,diphenyliodonium trifluoromethane sulfonate,diphenyliodonium; trifluoromethanesulfonate,diphenyliodanium; tris fluoranyl methanesulfonate |
| IUPAC Name | diphenyliodanium;trifluoromethanesulfonate |
| InChI Key | SBQIJPBUMNWUKN-UHFFFAOYSA-M |
| Molecular Formula | C13H10F3IO3S |
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
| 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 |
1-Fluoro-3-iodobenzene, 99%
CAS: 1121-86-4 Molecular Formula: C6H4FI Molecular Weight (g/mol): 222.00 MDL Number: MFCD00001044 InChI Key: VSKSBSORLCDRHS-UHFFFAOYSA-N Synonym: 3-fluoroiodobenzene,m-fluoroiodobenzene,3-iodofluorobenzene,m-iodofluorobenzene,benzene, 1-fluoro-3-iodo,m-fluorobenzene,1-fluoro-3-iodo-benzene,1-iodo-3-fluorobenzene,3-fluoro-1-iodobenzene,m-fluorjodbenzol PubChem CID: 70725 IUPAC Name: 1-fluoro-3-iodobenzene SMILES: FC1=CC=CC(I)=C1
| PubChem CID | 70725 |
|---|---|
| CAS | 1121-86-4 |
| Molecular Weight (g/mol) | 222.00 |
| MDL Number | MFCD00001044 |
| SMILES | FC1=CC=CC(I)=C1 |
| Synonym | 3-fluoroiodobenzene,m-fluoroiodobenzene,3-iodofluorobenzene,m-iodofluorobenzene,benzene, 1-fluoro-3-iodo,m-fluorobenzene,1-fluoro-3-iodo-benzene,1-iodo-3-fluorobenzene,3-fluoro-1-iodobenzene,m-fluorjodbenzol |
| IUPAC Name | 1-fluoro-3-iodobenzene |
| InChI Key | VSKSBSORLCDRHS-UHFFFAOYSA-N |
| Molecular Formula | C6H4FI |
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
| 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 |
1-Iodo-2-(trifluoromethoxy)benzene, 97%, Thermo Scientific™
CAS: 175278-00-9 Molecular Formula: C7H4F3IO Molecular Weight (g/mol): 288.01 MDL Number: MFCD00042410 InChI Key: GYBMJVZOZTVDKS-UHFFFAOYSA-N Synonym: 1-iodo-2-trifluoromethoxy benzene,2-trifluoromethoxy iodobenzene,benzene, 1-iodo-2-trifluoromethoxy,2-iodo trifluoromethoxy benzene,o-iodotrifluoromethoxybenzene,o-trifluoromethoxy iodobenzene,alpha,alpha,alpha-trifluoro-2-iodoanisole,pubchem1077,acmc-1ca3h,ksc494o5n PubChem CID: 2777292 IUPAC Name: 1-iodo-2-(trifluoromethoxy)benzene SMILES: FC(F)(F)OC1=CC=CC=C1I
| PubChem CID | 2777292 |
|---|---|
| CAS | 175278-00-9 |
| Molecular Weight (g/mol) | 288.01 |
| MDL Number | MFCD00042410 |
| SMILES | FC(F)(F)OC1=CC=CC=C1I |
| Synonym | 1-iodo-2-trifluoromethoxy benzene,2-trifluoromethoxy iodobenzene,benzene, 1-iodo-2-trifluoromethoxy,2-iodo trifluoromethoxy benzene,o-iodotrifluoromethoxybenzene,o-trifluoromethoxy iodobenzene,alpha,alpha,alpha-trifluoro-2-iodoanisole,pubchem1077,acmc-1ca3h,ksc494o5n |
| IUPAC Name | 1-iodo-2-(trifluoromethoxy)benzene |
| InChI Key | GYBMJVZOZTVDKS-UHFFFAOYSA-N |
| Molecular Formula | C7H4F3IO |
Diphenyliodonium trifluoromethanesulfonate, 99%
CAS: 66003-76-7 Molecular Formula: C12H10I·CF3O3S Molecular Weight (g/mol): 430.18 MDL Number: MFCD00191356 InChI Key: SBQIJPBUMNWUKN-UHFFFAOYSA-M Synonym: diphenyliodonium trifluoromethanesulfonate,diphenyliodanium triflate,diphenyliodonium triflate,acmc-209nt6,diphenyliodonium trifluoromethansulfonat,diphenyliodanium; trifluoromethanesulfonate,diphenyliodonium trifluoromethane sulfonate,diphenyliodonium; trifluoromethanesulfonate,diphenyliodanium; tris fluoranyl methanesulfonate PubChem CID: 2737137 IUPAC Name: diphenyliodanium;trifluoromethanesulfonate SMILES: C1=CC=C(C=C1)[I+]C2=CC=CC=C2.C(F)(F)(F)S(=O)(=O)[O-]
| PubChem CID | 2737137 |
|---|---|
| CAS | 66003-76-7 |
| Molecular Weight (g/mol) | 430.18 |
| MDL Number | MFCD00191356 |
| SMILES | C1=CC=C(C=C1)[I+]C2=CC=CC=C2.C(F)(F)(F)S(=O)(=O)[O-] |
| Synonym | diphenyliodonium trifluoromethanesulfonate,diphenyliodanium triflate,diphenyliodonium triflate,acmc-209nt6,diphenyliodonium trifluoromethansulfonat,diphenyliodanium; trifluoromethanesulfonate,diphenyliodonium trifluoromethane sulfonate,diphenyliodonium; trifluoromethanesulfonate,diphenyliodanium; tris fluoranyl methanesulfonate |
| IUPAC Name | diphenyliodanium;trifluoromethanesulfonate |
| InChI Key | SBQIJPBUMNWUKN-UHFFFAOYSA-M |
| Molecular Formula | C12H10I·CF3O3S |
2-Iodotoluene, 98%
CAS: 615-37-2 Molecular Formula: C7H7I Molecular Weight (g/mol): 218.037 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
| PubChem CID | 5128 |
|---|---|
| CAS | 615-37-2 |
| Molecular Weight (g/mol) | 218.037 |
| 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 |
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-$l^ 5-phosphanuide PubChem CID: 2737136 IUPAC Name: diphenyliodanium SMILES: [I+](C1=CC=CC=C1)C1=CC=CC=C1
| PubChem CID | 2737136 |
|---|---|
| CAS | 58109-40-3 |
| Molecular Weight (g/mol) | 281.12 |
| MDL Number | MFCD00061398 |
| SMILES | [I+](C1=CC=CC=C1)C1=CC=CC=C1 |
| Synonym | diphenyliodonium hexafluorophosphate,diphenyliodanium hexafluorophosphate,diphenyliodonium hexafluorophosphate v,iodonium, diphenyl-, hexafluorophosphate 1-,iodonium, diphenyl-, hexafluorophosphate 1-1:1,diphenyliodonium pf6,dpihfp,acmc-209m2o,phi + pf6-,diphenyliodanium; hexafluoro-$l^ 5-phosphanuide |
| IUPAC Name | diphenyliodanium |
| InChI Key | OZLBDYMWFAHSOQ-UHFFFAOYSA-N |
| Molecular Formula | C12H10I |