Benzenoids
Filtered Search Results
3-(3,4-Dichlorophenyl)-1,1-dimethylurea, 97%
CAS: 330-54-1 Molecular Formula: C9H10Cl2N2O Molecular Weight (g/mol): 233.092 MDL Number: MFCD00018136 InChI Key: XMTQQYYKAHVGBJ-UHFFFAOYSA-N Synonym: diuron,3-3,4-dichlorophenyl-1,1-dimethylurea,dcmu,dynex,duran,dichlorfenidim,herbatox,vonduron,dailon,karmex PubChem CID: 3120 ChEBI: CHEBI:116509 IUPAC Name: 3-(3,4-dichlorophenyl)-1,1-dimethylurea SMILES: CN(C)C(=O)NC1=CC(=C(C=C1)Cl)Cl
| PubChem CID | 3120 |
|---|---|
| CAS | 330-54-1 |
| Molecular Weight (g/mol) | 233.092 |
| ChEBI | CHEBI:116509 |
| MDL Number | MFCD00018136 |
| SMILES | CN(C)C(=O)NC1=CC(=C(C=C1)Cl)Cl |
| Synonym | diuron,3-3,4-dichlorophenyl-1,1-dimethylurea,dcmu,dynex,duran,dichlorfenidim,herbatox,vonduron,dailon,karmex |
| IUPAC Name | 3-(3,4-dichlorophenyl)-1,1-dimethylurea |
| InChI Key | XMTQQYYKAHVGBJ-UHFFFAOYSA-N |
| Molecular Formula | C9H10Cl2N2O |
p-Toluenesulfonic acid monohydrate, 97.5%, pure
CAS: 6192-52-5 MDL Number: MFCD00142137 InChI Key: KJIFKLIQANRMOU-UHFFFAOYSA-N Synonym: p-toluenesulfonic acid monohydrate,4-methylbenzenesulfonic acid hydrate,4-methylbenzenesulfonic acid monohydrate,p-toluene sulfonic acid monohydrate,unii-3bto78gaff,benzenesulfonic acid, 4-methyl-, monohydrate,ptoluenesulfonic acid,p-toluenesulfonic acid, monohydrate,3bto78gaff,4-methylbenzene-1-sulfonic acid hydrate PubChem CID: 521998 IUPAC Name: 4-methylbenzenesulfonic acid;hydrate SMILES: CC1=CC=C(C=C1)S(=O)(=O)O.O
| PubChem CID | 521998 |
|---|---|
| CAS | 6192-52-5 |
| MDL Number | MFCD00142137 |
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)O.O |
| Synonym | p-toluenesulfonic acid monohydrate,4-methylbenzenesulfonic acid hydrate,4-methylbenzenesulfonic acid monohydrate,p-toluene sulfonic acid monohydrate,unii-3bto78gaff,benzenesulfonic acid, 4-methyl-, monohydrate,ptoluenesulfonic acid,p-toluenesulfonic acid, monohydrate,3bto78gaff,4-methylbenzene-1-sulfonic acid hydrate |
| IUPAC Name | 4-methylbenzenesulfonic acid;hydrate |
| InChI Key | KJIFKLIQANRMOU-UHFFFAOYSA-N |
Mesitylenesulfonic acid sodium salt hemihydrate, 98%
CAS: 6148-75-0 Molecular Formula: C9H11NaO3S Molecular Weight (g/mol): 222.23 MDL Number: MFCD00067712 InChI Key: AOJUNZYQOYSGHT-UHFFFAOYSA-M Synonym: sodium mesitylenesulfonate,benzenesulfonic acid, 2,4,6-trimethyl-, sodium salt,sodium 2,4,6-trimethylbenzenesulfonate,sodium 2,4,6-trimethylbenzenesulphonate,mesitylenesulfonic acid sodium salt hemihydrate,mesitylenesulfonic acid sodium salt,benzenesulfonic acid, 2,4,6-trimethyl-, sodium salt 1:1,2,4,6-trimethylbenzenesulfonic acid sodium salt,mesitylene sodium sulfonate,acmc-1bbae PubChem CID: 23661859 IUPAC Name: sodium;2,4,6-trimethylbenzenesulfonate SMILES: [Na+].CC1=CC(C)=C(C(C)=C1)S([O-])(=O)=O
| PubChem CID | 23661859 |
|---|---|
| CAS | 6148-75-0 |
| Molecular Weight (g/mol) | 222.23 |
| MDL Number | MFCD00067712 |
| SMILES | [Na+].CC1=CC(C)=C(C(C)=C1)S([O-])(=O)=O |
| Synonym | sodium mesitylenesulfonate,benzenesulfonic acid, 2,4,6-trimethyl-, sodium salt,sodium 2,4,6-trimethylbenzenesulfonate,sodium 2,4,6-trimethylbenzenesulphonate,mesitylenesulfonic acid sodium salt hemihydrate,mesitylenesulfonic acid sodium salt,benzenesulfonic acid, 2,4,6-trimethyl-, sodium salt 1:1,2,4,6-trimethylbenzenesulfonic acid sodium salt,mesitylene sodium sulfonate,acmc-1bbae |
| IUPAC Name | sodium;2,4,6-trimethylbenzenesulfonate |
| InChI Key | AOJUNZYQOYSGHT-UHFFFAOYSA-M |
| Molecular Formula | C9H11NaO3S |
3-Sulfobenzoic acid monosodium salt, 97%
CAS: 17625-03-5 Molecular Formula: C7H5NaO5S Molecular Weight (g/mol): 224.162 MDL Number: MFCD00066378 InChI Key: KQHKITXZJDOIOD-UHFFFAOYSA-M PubChem CID: 23668512 IUPAC Name: sodium;3-sulfobenzoate SMILES: C1=CC(=CC(=C1)S(=O)(=O)O)C(=O)[O-].[Na+]
| PubChem CID | 23668512 |
|---|---|
| CAS | 17625-03-5 |
| Molecular Weight (g/mol) | 224.162 |
| MDL Number | MFCD00066378 |
| SMILES | C1=CC(=CC(=C1)S(=O)(=O)O)C(=O)[O-].[Na+] |
| IUPAC Name | sodium;3-sulfobenzoate |
| InChI Key | KQHKITXZJDOIOD-UHFFFAOYSA-M |
| Molecular Formula | C7H5NaO5S |
Hydroxy(tosyloxy)iodobenzene, 97%
CAS: 27126-76-7 Molecular Formula: C13H13IO4S Molecular Weight (g/mol): 392.207 MDL Number: MFCD00011547 InChI Key: LRIUKPUCKCECPT-UHFFFAOYSA-N Synonym: hydroxy tosyloxy iodo benzene,htib,koser's reagent,phenyliodosohydroxy tosylate,koser reagent,unii-2eoa97b14a,hydroxy p-tolylsulfonyl oxy iodo benzene,hydroxy 4-methylbenzenesulfonato-o phenyliodine,iodosobenzene-i-mono-p-toluenesulfonate,hydroxy phenyl 4-methylbenzenesulfonoperoxoyl iodide PubChem CID: 325434 IUPAC Name: [hydroxy(phenyl)-$l^{3}-iodanyl] 4-methylbenzenesulfonate SMILES: CC1=CC=C(C=C1)S(=O)(=O)OI(C2=CC=CC=C2)O
| PubChem CID | 325434 |
|---|---|
| CAS | 27126-76-7 |
| Molecular Weight (g/mol) | 392.207 |
| MDL Number | MFCD00011547 |
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)OI(C2=CC=CC=C2)O |
| Synonym | hydroxy tosyloxy iodo benzene,htib,koser's reagent,phenyliodosohydroxy tosylate,koser reagent,unii-2eoa97b14a,hydroxy p-tolylsulfonyl oxy iodo benzene,hydroxy 4-methylbenzenesulfonato-o phenyliodine,iodosobenzene-i-mono-p-toluenesulfonate,hydroxy phenyl 4-methylbenzenesulfonoperoxoyl iodide |
| IUPAC Name | [hydroxy(phenyl)-$l^{3}-iodanyl] 4-methylbenzenesulfonate |
| InChI Key | LRIUKPUCKCECPT-UHFFFAOYSA-N |
| Molecular Formula | C13H13IO4S |
2,4-Dinitrobenzenesulfonic acid sodium salt, 97%
CAS: 885-62-1 Molecular Formula: C6H3N2NaO7S Molecular Weight (g/mol): 270.15 MDL Number: MFCD00007471,MFCD10567393 InChI Key: GSBYVRKLPCSLNV-UHFFFAOYSA-M Synonym: sodium 2,4-dinitrobenzenesulfonate hydrate,acmc-209quh,sodium dnbs hydrate,2,4-dinitrobenzenesulfonic acid sodium salt hydrate PubChem CID: 70700115 IUPAC Name: sodium;2,4-dinitrobenzenesulfonate;hydrate SMILES: [Na+].[O-][N+](=O)C1=CC=C(C(=C1)[N+]([O-])=O)S([O-])(=O)=O
| PubChem CID | 70700115 |
|---|---|
| CAS | 885-62-1 |
| Molecular Weight (g/mol) | 270.15 |
| MDL Number | MFCD00007471,MFCD10567393 |
| SMILES | [Na+].[O-][N+](=O)C1=CC=C(C(=C1)[N+]([O-])=O)S([O-])(=O)=O |
| Synonym | sodium 2,4-dinitrobenzenesulfonate hydrate,acmc-209quh,sodium dnbs hydrate,2,4-dinitrobenzenesulfonic acid sodium salt hydrate |
| IUPAC Name | sodium;2,4-dinitrobenzenesulfonate;hydrate |
| InChI Key | GSBYVRKLPCSLNV-UHFFFAOYSA-M |
| Molecular Formula | C6H3N2NaO7S |
1,3-Dichloro-2-iodobenzene, 98%
CAS: 19230-28-5 Molecular Formula: C6H3Cl2I Molecular Weight (g/mol): 272.89 MDL Number: MFCD00060658 InChI Key: ZMPGXSFTXBOKFM-UHFFFAOYSA-N PubChem CID: 140498 IUPAC Name: 1,3-dichloro-2-iodobenzene SMILES: ClC1=CC=CC(Cl)=C1I
| PubChem CID | 140498 |
|---|---|
| CAS | 19230-28-5 |
| Molecular Weight (g/mol) | 272.89 |
| MDL Number | MFCD00060658 |
| SMILES | ClC1=CC=CC(Cl)=C1I |
| IUPAC Name | 1,3-dichloro-2-iodobenzene |
| InChI Key | ZMPGXSFTXBOKFM-UHFFFAOYSA-N |
| Molecular Formula | C6H3Cl2I |
4-Benzylaniline, 98%
CAS: 1135-12-2 Molecular Formula: C13H13N Molecular Weight (g/mol): 183.254 MDL Number: MFCD00047861 InChI Key: WDTRNCFZFQIWLM-UHFFFAOYSA-N Synonym: 4-aminodiphenylmethane,benzenamine, 4-phenylmethyl,4-benzyl-phenylamine,4-benzylbenzenamine,4-benzylphenylamine,4-benzylaniline, hcl,4-benzyl aniline,4-benzyl-aniline,#,p-aminodiphenylmethan PubChem CID: 136914 IUPAC Name: 4-benzylaniline SMILES: C1=CC=C(C=C1)CC2=CC=C(C=C2)N
| PubChem CID | 136914 |
|---|---|
| CAS | 1135-12-2 |
| Molecular Weight (g/mol) | 183.254 |
| MDL Number | MFCD00047861 |
| SMILES | C1=CC=C(C=C1)CC2=CC=C(C=C2)N |
| Synonym | 4-aminodiphenylmethane,benzenamine, 4-phenylmethyl,4-benzyl-phenylamine,4-benzylbenzenamine,4-benzylphenylamine,4-benzylaniline, hcl,4-benzyl aniline,4-benzyl-aniline,#,p-aminodiphenylmethan |
| IUPAC Name | 4-benzylaniline |
| InChI Key | WDTRNCFZFQIWLM-UHFFFAOYSA-N |
| Molecular Formula | C13H13N |
(S)-2-Diphenylmethylpyrrolidine, 97+%
CAS: 119237-64-8 Molecular Formula: C17H20N Molecular Weight (g/mol): 238.35 MDL Number: MFCD00799525 InChI Key: OXOBKZZXZVFOBB-INIZCTEOSA-O Synonym: s-2-benzhydrylpyrrolidine,s---2-diphenylmethyl pyrrolidine,s-2-diphenylmethylpyrrolidine,2s-2-diphenylmethyl pyrrolidine,2s-2-benzhydrylpyrrolidine,2s-2-benzylhydrylpyrrolidine,2r-2-benzhydrylpyrrolidine,pubchem18168,2alpha-benzhydrylpyrrolidine,s-2-benzhydryl-pyrrolidine PubChem CID: 2734053 SMILES: C1C[NH2+][C@@H](C1)C(C1=CC=CC=C1)C1=CC=CC=C1
| PubChem CID | 2734053 |
|---|---|
| CAS | 119237-64-8 |
| Molecular Weight (g/mol) | 238.35 |
| MDL Number | MFCD00799525 |
| SMILES | C1C[NH2+][C@@H](C1)C(C1=CC=CC=C1)C1=CC=CC=C1 |
| Synonym | s-2-benzhydrylpyrrolidine,s---2-diphenylmethyl pyrrolidine,s-2-diphenylmethylpyrrolidine,2s-2-diphenylmethyl pyrrolidine,2s-2-benzhydrylpyrrolidine,2s-2-benzylhydrylpyrrolidine,2r-2-benzhydrylpyrrolidine,pubchem18168,2alpha-benzhydrylpyrrolidine,s-2-benzhydryl-pyrrolidine |
| InChI Key | OXOBKZZXZVFOBB-INIZCTEOSA-O |
| Molecular Formula | C17H20N |
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
| 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 |
3-Iodobenzeneboronic acid, 97%
CAS: 221037-98-5 Molecular Formula: C6H6BIO2 Molecular Weight (g/mol): 247.826 MDL Number: MFCD01319015 InChI Key: REEUXWXIMNEIIN-UHFFFAOYSA-N Synonym: 3-iodophenyl boronic acid,boronic acid, 3-iodophenyl,3-iodobenzeneboronic acid,pentanedioic acid 1-1r,2s,5r-5-methyl-2-1-methylethyl cyclohexyl ester,pubchem6224,acmc-1ckkp,3-iodophenylboranic acid,amtb078,3-iodanylphenyl boronic acid,boronic acid,b-3-iodophenyl PubChem CID: 2734362 IUPAC Name: (3-iodophenyl)boronic acid SMILES: B(C1=CC(=CC=C1)I)(O)O
| PubChem CID | 2734362 |
|---|---|
| CAS | 221037-98-5 |
| Molecular Weight (g/mol) | 247.826 |
| MDL Number | MFCD01319015 |
| SMILES | B(C1=CC(=CC=C1)I)(O)O |
| Synonym | 3-iodophenyl boronic acid,boronic acid, 3-iodophenyl,3-iodobenzeneboronic acid,pentanedioic acid 1-1r,2s,5r-5-methyl-2-1-methylethyl cyclohexyl ester,pubchem6224,acmc-1ckkp,3-iodophenylboranic acid,amtb078,3-iodanylphenyl boronic acid,boronic acid,b-3-iodophenyl |
| IUPAC Name | (3-iodophenyl)boronic acid |
| InChI Key | REEUXWXIMNEIIN-UHFFFAOYSA-N |
| Molecular Formula | C6H6BIO2 |
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 |
1-Bromo-3-iodobenzene, 98+%
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 |
1-(3-Iodobenzyl)-1H-1,2,4-triazole, ≥95%, Thermo Scientific™
CAS: 615534-73-1 Molecular Formula: C9H8IN3 Molecular Weight (g/mol): 285.088 MDL Number: MFCD08271930 InChI Key: RFHFJBONYNRFAA-UHFFFAOYSA-N Synonym: 1-3-iodobenzyl-1h-1,2,4-triazole,1-3-iodophenyl methyl-1,2,4-triazole,1h-1,2,4-triazole,1-3-iodophenyl methyl,1-3-iodobenzyl-1h-1,2,4 triazole,3-1h-1,2,4-triazol-1-ylmethyl iodobenzene,1-3-iodophenyl methyl-1h-1,2,4-triazole PubChem CID: 18525776 IUPAC Name: 1-[(3-iodophenyl)methyl]-1,2,4-triazole SMILES: C1=CC(=CC(=C1)I)CN2C=NC=N2
| PubChem CID | 18525776 |
|---|---|
| CAS | 615534-73-1 |
| Molecular Weight (g/mol) | 285.088 |
| MDL Number | MFCD08271930 |
| SMILES | C1=CC(=CC(=C1)I)CN2C=NC=N2 |
| Synonym | 1-3-iodobenzyl-1h-1,2,4-triazole,1-3-iodophenyl methyl-1,2,4-triazole,1h-1,2,4-triazole,1-3-iodophenyl methyl,1-3-iodobenzyl-1h-1,2,4 triazole,3-1h-1,2,4-triazol-1-ylmethyl iodobenzene,1-3-iodophenyl methyl-1h-1,2,4-triazole |
| IUPAC Name | 1-[(3-iodophenyl)methyl]-1,2,4-triazole |
| InChI Key | RFHFJBONYNRFAA-UHFFFAOYSA-N |
| Molecular Formula | C9H8IN3 |
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 |