Benzene and substituted derivatives
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[RuCl(p-cymene)((S)-segphos(regR))]Cl, TCI America™
CAS: 944451-29-0 Molecular Formula: C48H42Cl2O4P2Ru Molecular Weight (g/mol): 916.778 MDL Number: MFCD09753017 InChI Key: HZLSGDCLBWZKRB-UHFFFAOYSA-L Synonym: Chloro[(S)-(-)-5,5′C-bis(diphenylphosphino)-4,4′C-bi-1,3-benzodioxole](p-cymene)ruthenium(II) Chloride PubChem CID: 72376325 IUPAC Name: dichlororuthenium;[4-(5-diphenylphosphanyl-1,3-benzodioxol-4-yl)-1,3-benzodioxol-5-yl]-diphenylphosphane;1-methyl-4-propan-2-ylbenzene SMILES: CC1=CC=C(C=C1)C(C)C.C1OC2=C(O1)C(=C(C=C2)P(C3=CC=CC=C3)C4=CC=CC=C4)C5=C(C=CC6=C5OCO6)P(C7=CC=CC=C7)C8=CC=CC=C8.Cl[Ru]Cl
| PubChem CID | 72376325 |
|---|---|
| CAS | 944451-29-0 |
| Molecular Weight (g/mol) | 916.778 |
| MDL Number | MFCD09753017 |
| SMILES | CC1=CC=C(C=C1)C(C)C.C1OC2=C(O1)C(=C(C=C2)P(C3=CC=CC=C3)C4=CC=CC=C4)C5=C(C=CC6=C5OCO6)P(C7=CC=CC=C7)C8=CC=CC=C8.Cl[Ru]Cl |
| Synonym | Chloro[(S)-(-)-5,5′C-bis(diphenylphosphino)-4,4′C-bi-1,3-benzodioxole](p-cymene)ruthenium(II) Chloride |
| IUPAC Name | dichlororuthenium;[4-(5-diphenylphosphanyl-1,3-benzodioxol-4-yl)-1,3-benzodioxol-5-yl]-diphenylphosphane;1-methyl-4-propan-2-ylbenzene |
| InChI Key | HZLSGDCLBWZKRB-UHFFFAOYSA-L |
| Molecular Formula | C48H42Cl2O4P2Ru |
4-Nitrotoluene-2-sulfonic Acid Hydrate 95.0+%, TCI America™
CAS: 121-03-9 Molecular Formula: C7H7NO5S Molecular Weight (g/mol): 217.195 MDL Number: MFCD00024914 InChI Key: ZDTXQHVBLWYPHS-UHFFFAOYSA-N PubChem CID: 8458 ChEBI: CHEBI:67120 SMILES: CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)O
| PubChem CID | 8458 |
|---|---|
| CAS | 121-03-9 |
| Molecular Weight (g/mol) | 217.195 |
| ChEBI | CHEBI:67120 |
| MDL Number | MFCD00024914 |
| SMILES | CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)O |
| InChI Key | ZDTXQHVBLWYPHS-UHFFFAOYSA-N |
| Molecular Formula | C7H7NO5S |
4-Nitrophenylhydrazine Hydrochloride 98.0+%, TCI America™
CAS: 636-99-7 Molecular Formula: C6H8ClN3O2 Molecular Weight (g/mol): 189.599 MDL Number: MFCD00040592 InChI Key: ZWWXDCOPVYATOQ-UHFFFAOYSA-N Synonym: 4-nitrophenylhydrazine hydrochloride,4-nitrophenyl hydrazine hydrochloride,4-nitrophenyhydrazine hydrochloride,4-nitrophenylhydrazinehydrochloride,4-nitrophenyl hydrazine, hcl,p-nitrophenylhydrazine hcl,nitrophenylhydrazine hydrochloride,hydrazine, 4-nitrophenyl-, monohydrochloride,p-nitrophenylhydrazine hydrochloride PubChem CID: 5463401 IUPAC Name: (4-nitrophenyl)hydrazine;hydrochloride SMILES: C1=CC(=CC=C1NN)[N+](=O)[O-].Cl
| PubChem CID | 5463401 |
|---|---|
| CAS | 636-99-7 |
| Molecular Weight (g/mol) | 189.599 |
| MDL Number | MFCD00040592 |
| SMILES | C1=CC(=CC=C1NN)[N+](=O)[O-].Cl |
| Synonym | 4-nitrophenylhydrazine hydrochloride,4-nitrophenyl hydrazine hydrochloride,4-nitrophenyhydrazine hydrochloride,4-nitrophenylhydrazinehydrochloride,4-nitrophenyl hydrazine, hcl,p-nitrophenylhydrazine hcl,nitrophenylhydrazine hydrochloride,hydrazine, 4-nitrophenyl-, monohydrochloride,p-nitrophenylhydrazine hydrochloride |
| IUPAC Name | (4-nitrophenyl)hydrazine;hydrochloride |
| InChI Key | ZWWXDCOPVYATOQ-UHFFFAOYSA-N |
| Molecular Formula | C6H8ClN3O2 |
1-Bromo-2-fluoro-4-iodobenzene 97.0+%, TCI America™
CAS: 136434-77-0 Molecular Formula: C6H3BrFI Molecular Weight (g/mol): 300.90 MDL Number: MFCD00042577 InChI Key: OCODJNASCDFXSR-UHFFFAOYSA-N Synonym: 4-bromo-3-fluoroiodobenzene,3-fluoro-4-bromo iodobenzene,1-bromo-2-fluoro-4-iodo-benzene,benzene, 1-bromo-2-fluoro-4-iodo,3-fluoro-4-bromo-iodobenzene,1-bromo-2-fluoro-4-i,pubchem3231,acmc-209c5x,3-fluoro-4-bromoiodobenzene,ksc490o1h PubChem CID: 2725006 IUPAC Name: 1-bromo-2-fluoro-4-iodobenzene SMILES: FC1=C(Br)C=CC(I)=C1
| PubChem CID | 2725006 |
|---|---|
| CAS | 136434-77-0 |
| Molecular Weight (g/mol) | 300.90 |
| MDL Number | MFCD00042577 |
| SMILES | FC1=C(Br)C=CC(I)=C1 |
| Synonym | 4-bromo-3-fluoroiodobenzene,3-fluoro-4-bromo iodobenzene,1-bromo-2-fluoro-4-iodo-benzene,benzene, 1-bromo-2-fluoro-4-iodo,3-fluoro-4-bromo-iodobenzene,1-bromo-2-fluoro-4-i,pubchem3231,acmc-209c5x,3-fluoro-4-bromoiodobenzene,ksc490o1h |
| IUPAC Name | 1-bromo-2-fluoro-4-iodobenzene |
| InChI Key | OCODJNASCDFXSR-UHFFFAOYSA-N |
| Molecular Formula | C6H3BrFI |
Diethyl (4-Iodobenzyl)phosphonate 98.0+%, TCI America™
CAS: 173443-43-1 Molecular Formula: C11H16IO3P Molecular Weight (g/mol): 354.124 MDL Number: MFCD09033365 InChI Key: ACYSYNIYTMHNSY-UHFFFAOYSA-N Synonym: (4-Iodobenzyl)phosphonic Acid Diethyl Ester PubChem CID: 15166405 IUPAC Name: 1-(diethoxyphosphorylmethyl)-4-iodobenzene SMILES: CCOP(=O)(CC1=CC=C(C=C1)I)OCC
| PubChem CID | 15166405 |
|---|---|
| CAS | 173443-43-1 |
| Molecular Weight (g/mol) | 354.124 |
| MDL Number | MFCD09033365 |
| SMILES | CCOP(=O)(CC1=CC=C(C=C1)I)OCC |
| Synonym | (4-Iodobenzyl)phosphonic Acid Diethyl Ester |
| IUPAC Name | 1-(diethoxyphosphorylmethyl)-4-iodobenzene |
| InChI Key | ACYSYNIYTMHNSY-UHFFFAOYSA-N |
| Molecular Formula | C11H16IO3P |
4'-Butyl-4-iodobiphenyl 98.0+%, TCI America™
CAS: 199982-02-0 Molecular Formula: C16H17I Molecular Weight (g/mol): 336.216 MDL Number: MFCD16619281 InChI Key: KTEKHPDWAMYUBP-UHFFFAOYSA-N PubChem CID: 53417225 IUPAC Name: 1-butyl-4-(4-iodophenyl)benzene SMILES: CCCCC1=CC=C(C=C1)C2=CC=C(C=C2)I
| PubChem CID | 53417225 |
|---|---|
| CAS | 199982-02-0 |
| Molecular Weight (g/mol) | 336.216 |
| MDL Number | MFCD16619281 |
| SMILES | CCCCC1=CC=C(C=C1)C2=CC=C(C=C2)I |
| IUPAC Name | 1-butyl-4-(4-iodophenyl)benzene |
| InChI Key | KTEKHPDWAMYUBP-UHFFFAOYSA-N |
| Molecular Formula | C16H17I |
1-Bromo-4-fluoro-2-iodobenzene 98.0+%, TCI America™
CAS: 202865-72-3 Molecular Formula: C6H3BrFI Molecular Weight (g/mol): 300.897 MDL Number: MFCD00042578 InChI Key: QDCBSSUCEUMLGC-UHFFFAOYSA-N Synonym: 2-bromo-5-fluoroiodobenzene,4-fluoro-2-iodobromobenzene,2-iodo-4-fluorobromobenzene,1-bromo-4-fluoro-2-iodo-benzene,benzene, 1-bromo-4-fluoro-2-iodo,2-bromo-5-fluoro-1-iodobenzene,pubchem3233,acmc-1cljm,ksc493k3j,1-bromo-2-iodo-4-fluorobenzene PubChem CID: 2773370 IUPAC Name: 1-bromo-4-fluoro-2-iodobenzene SMILES: C1=CC(=C(C=C1F)I)Br
| PubChem CID | 2773370 |
|---|---|
| CAS | 202865-72-3 |
| Molecular Weight (g/mol) | 300.897 |
| MDL Number | MFCD00042578 |
| SMILES | C1=CC(=C(C=C1F)I)Br |
| Synonym | 2-bromo-5-fluoroiodobenzene,4-fluoro-2-iodobromobenzene,2-iodo-4-fluorobromobenzene,1-bromo-4-fluoro-2-iodo-benzene,benzene, 1-bromo-4-fluoro-2-iodo,2-bromo-5-fluoro-1-iodobenzene,pubchem3233,acmc-1cljm,ksc493k3j,1-bromo-2-iodo-4-fluorobenzene |
| IUPAC Name | 1-bromo-4-fluoro-2-iodobenzene |
| InChI Key | QDCBSSUCEUMLGC-UHFFFAOYSA-N |
| Molecular Formula | C6H3BrFI |
Sodium 2-Iodobenzenesulfonate 97.0+%, TCI America™
CAS: 62973-69-7 Molecular Formula: C6H4INaO3S Molecular Weight (g/mol): 306.049 MDL Number: MFCD12031329 InChI Key: KIPWXZMYZCPXGE-UHFFFAOYSA-M Synonym: 2-Iodobenzenesulfonic Acid Sodium Salt PubChem CID: 23662047 IUPAC Name: sodium;2-iodobenzenesulfonate SMILES: C1=CC=C(C(=C1)S(=O)(=O)[O-])I.[Na+]
| PubChem CID | 23662047 |
|---|---|
| CAS | 62973-69-7 |
| Molecular Weight (g/mol) | 306.049 |
| MDL Number | MFCD12031329 |
| SMILES | C1=CC=C(C(=C1)S(=O)(=O)[O-])I.[Na+] |
| Synonym | 2-Iodobenzenesulfonic Acid Sodium Salt |
| IUPAC Name | sodium;2-iodobenzenesulfonate |
| InChI Key | KIPWXZMYZCPXGE-UHFFFAOYSA-M |
| Molecular Formula | C6H4INaO3S |
2-Fluoro-6-iodotoluene 98.0+%, TCI America™
CAS: 443-85-6 Molecular Formula: C7H6FI Molecular Weight (g/mol): 236.03 MDL Number: MFCD00142922 InChI Key: MSPXWJMFEVAKHQ-UHFFFAOYSA-N Synonym: 2-fluoro-6-iodotoluene,pubchem1620,acmc-209xbg,ksc493m7j,benzene, 1-fluoro-3-iodo-2-methyl,1-fluoranyl-3-iodanyl-2-methyl-benzene PubChem CID: 2774523 IUPAC Name: 1-fluoro-3-iodo-2-methylbenzene SMILES: CC1=C(F)C=CC=C1I
| PubChem CID | 2774523 |
|---|---|
| CAS | 443-85-6 |
| Molecular Weight (g/mol) | 236.03 |
| MDL Number | MFCD00142922 |
| SMILES | CC1=C(F)C=CC=C1I |
| Synonym | 2-fluoro-6-iodotoluene,pubchem1620,acmc-209xbg,ksc493m7j,benzene, 1-fluoro-3-iodo-2-methyl,1-fluoranyl-3-iodanyl-2-methyl-benzene |
| IUPAC Name | 1-fluoro-3-iodo-2-methylbenzene |
| InChI Key | MSPXWJMFEVAKHQ-UHFFFAOYSA-N |
| Molecular Formula | C7H6FI |
4-Iodo-4'-propylbiphenyl 98.0+%, TCI America™
CAS: 782477-81-0 Molecular Formula: C15H15I Molecular Weight (g/mol): 322.19 MDL Number: MFCD12923241 InChI Key: MKDLYSABBHXXSV-UHFFFAOYSA-N PubChem CID: 53401151 IUPAC Name: 4-iodo-4'-propyl-1,1'-biphenyl SMILES: CCCC1=CC=C(C=C1)C1=CC=C(I)C=C1
| PubChem CID | 53401151 |
|---|---|
| CAS | 782477-81-0 |
| Molecular Weight (g/mol) | 322.19 |
| MDL Number | MFCD12923241 |
| SMILES | CCCC1=CC=C(C=C1)C1=CC=C(I)C=C1 |
| IUPAC Name | 4-iodo-4'-propyl-1,1'-biphenyl |
| InChI Key | MKDLYSABBHXXSV-UHFFFAOYSA-N |
| Molecular Formula | C15H15I |
1-Bromo-3-iodobenzene (stabilized with Copper chip) 97.0+%, TCI America™
CAS: 591-18-4 Molecular Formula: C6H4BrI Molecular Weight (g/mol): 282.91 MDL Number: MFCD00001043 InChI Key: CTPUUDQIXKUAMO-UHFFFAOYSA-N Synonym: 3-bromoiodobenzene,benzene, 1-bromo-3-iodo,m-bromoiodobenzene,1-bromo-3-iodo-benzene,3-bromo-1-iodobenzene,attercop-chm at127411,m-bromjodbenzol,3-iodobromobenzene,3-bromo iodobenzene PubChem CID: 11561 IUPAC Name: 1-bromo-3-iodobenzene SMILES: BrC1=CC=CC(I)=C1
| PubChem CID | 11561 |
|---|---|
| CAS | 591-18-4 |
| Molecular Weight (g/mol) | 282.91 |
| MDL Number | MFCD00001043 |
| SMILES | BrC1=CC=CC(I)=C1 |
| Synonym | 3-bromoiodobenzene,benzene, 1-bromo-3-iodo,m-bromoiodobenzene,1-bromo-3-iodo-benzene,3-bromo-1-iodobenzene,attercop-chm at127411,m-bromjodbenzol,3-iodobromobenzene,3-bromo iodobenzene |
| IUPAC Name | 1-bromo-3-iodobenzene |
| InChI Key | CTPUUDQIXKUAMO-UHFFFAOYSA-N |
| Molecular Formula | C6H4BrI |
4-Iodo-4'-nitrobiphenyl 98.0+%, TCI America™
CAS: 29170-08-9 Molecular Formula: C12H8INO2 Molecular Weight (g/mol): 325.11 MDL Number: MFCD00024698 InChI Key: YEDVRRNLTGKJSW-UHFFFAOYSA-N PubChem CID: 120142 IUPAC Name: 4-iodo-4'-nitro-1,1'-biphenyl SMILES: [O-][N+](=O)C1=CC=C(C=C1)C1=CC=C(I)C=C1
| PubChem CID | 120142 |
|---|---|
| CAS | 29170-08-9 |
| Molecular Weight (g/mol) | 325.11 |
| MDL Number | MFCD00024698 |
| SMILES | [O-][N+](=O)C1=CC=C(C=C1)C1=CC=C(I)C=C1 |
| IUPAC Name | 4-iodo-4'-nitro-1,1'-biphenyl |
| InChI Key | YEDVRRNLTGKJSW-UHFFFAOYSA-N |
| Molecular Formula | C12H8INO2 |
4-Fluoro-2-iodo-1-nitrobenzene 98.0+%, TCI America™
CAS: 41860-64-4 Molecular Formula: C6H3FINO2 Molecular Weight (g/mol): 267.00 MDL Number: MFCD16658618 InChI Key: QKROTSNREAHREK-UHFFFAOYSA-N PubChem CID: 19361948 IUPAC Name: 4-fluoro-2-iodo-1-nitrobenzene SMILES: [O-][N+](=O)C1=C(I)C=C(F)C=C1
| PubChem CID | 19361948 |
|---|---|
| CAS | 41860-64-4 |
| Molecular Weight (g/mol) | 267.00 |
| MDL Number | MFCD16658618 |
| SMILES | [O-][N+](=O)C1=C(I)C=C(F)C=C1 |
| IUPAC Name | 4-fluoro-2-iodo-1-nitrobenzene |
| InChI Key | QKROTSNREAHREK-UHFFFAOYSA-N |
| Molecular Formula | C6H3FINO2 |
2-Bromo-5-iodotoluene 98.0+%, TCI America™
CAS: 202865-85-8 Molecular Formula: C7H6BrI Molecular Weight (g/mol): 296.933 MDL Number: MFCD00070749 InChI Key: QSQOGKONVJDRNH-UHFFFAOYSA-N PubChem CID: 2735574 IUPAC Name: 1-bromo-4-iodo-2-methylbenzene SMILES: CC1=C(C=CC(=C1)I)Br
| PubChem CID | 2735574 |
|---|---|
| CAS | 202865-85-8 |
| Molecular Weight (g/mol) | 296.933 |
| MDL Number | MFCD00070749 |
| SMILES | CC1=C(C=CC(=C1)I)Br |
| IUPAC Name | 1-bromo-4-iodo-2-methylbenzene |
| InChI Key | QSQOGKONVJDRNH-UHFFFAOYSA-N |
| Molecular Formula | C7H6BrI |