Benzenoids
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1-Bromo-4-dodecylbenzene 95.0+%, TCI America™
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CAS: 126930-72-1 Molecular Formula: C18H29Br Molecular Weight (g/mol): 325.334 MDL Number: MFCD00191386 InChI Key: RFFMRBISTZHCNY-UHFFFAOYSA-N Synonym: 4-dodecylbromobenzene,1-bromo-4-n-dodecylbenzene,benzene, 1-bromo-4-dodecyl,4-bromododecylbenzene,pubchem22735,acmc-209bby,1-bromo-4-dodecyl-benzene,ksc494g6d,4-n-dodecylbromobenzene PubChem CID: 15120506 IUPAC Name: 1-bromo-4-dodecylbenzene SMILES: CCCCCCCCCCCCC1=CC=C(C=C1)Br
| PubChem CID | 15120506 |
|---|---|
| CAS | 126930-72-1 |
| Molecular Weight (g/mol) | 325.334 |
| MDL Number | MFCD00191386 |
| SMILES | CCCCCCCCCCCCC1=CC=C(C=C1)Br |
| Synonym | 4-dodecylbromobenzene,1-bromo-4-n-dodecylbenzene,benzene, 1-bromo-4-dodecyl,4-bromododecylbenzene,pubchem22735,acmc-209bby,1-bromo-4-dodecyl-benzene,ksc494g6d,4-n-dodecylbromobenzene |
| IUPAC Name | 1-bromo-4-dodecylbenzene |
| InChI Key | RFFMRBISTZHCNY-UHFFFAOYSA-N |
| Molecular Formula | C18H29Br |
2,4-Dihydroxybenzamide 98.0+%, TCI America™
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CAS: 3147-45-3 Molecular Formula: C7H7NO3 Molecular Weight (g/mol): 153.14 MDL Number: MFCD00064913 InChI Key: IIUJCQYKTGNRHH-UHFFFAOYSA-N PubChem CID: 76601 IUPAC Name: 2,4-dihydroxybenzamide SMILES: NC(=O)C1=CC=C(O)C=C1O
| PubChem CID | 76601 |
|---|---|
| CAS | 3147-45-3 |
| Molecular Weight (g/mol) | 153.14 |
| MDL Number | MFCD00064913 |
| SMILES | NC(=O)C1=CC=C(O)C=C1O |
| IUPAC Name | 2,4-dihydroxybenzamide |
| InChI Key | IIUJCQYKTGNRHH-UHFFFAOYSA-N |
| Molecular Formula | C7H7NO3 |
4-Methoxybenzyl Acetate 98.0+%, TCI America™
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CAS: 104-21-2 Molecular Formula: C10H12O3 Molecular Weight (g/mol): 180.20 MDL Number: MFCD00038509 InChI Key: HFNGYHHRRMSKEU-UHFFFAOYSA-N Synonym: 4-methoxybenzyl acetate,anisyl acetate,cassie ketone,4-methoxyphenyl methyl acetate,p-anisyl acetate,p-methoxybenzyl acetate,p-methoxybenzyl alcohol acetate,benzyl alcohol, p-methoxy-, acetate,benzenemethanol, 4-methoxy-, acetate,benzenemethanol, 4-methoxy-, 1-acetate PubChem CID: 7695 ChEBI: CHEBI:86743 IUPAC Name: (4-methoxyphenyl)methyl acetate SMILES: COC1=CC=C(COC(C)=O)C=C1
| PubChem CID | 7695 |
|---|---|
| CAS | 104-21-2 |
| Molecular Weight (g/mol) | 180.20 |
| ChEBI | CHEBI:86743 |
| MDL Number | MFCD00038509 |
| SMILES | COC1=CC=C(COC(C)=O)C=C1 |
| Synonym | 4-methoxybenzyl acetate,anisyl acetate,cassie ketone,4-methoxyphenyl methyl acetate,p-anisyl acetate,p-methoxybenzyl acetate,p-methoxybenzyl alcohol acetate,benzyl alcohol, p-methoxy-, acetate,benzenemethanol, 4-methoxy-, acetate,benzenemethanol, 4-methoxy-, 1-acetate |
| IUPAC Name | (4-methoxyphenyl)methyl acetate |
| InChI Key | HFNGYHHRRMSKEU-UHFFFAOYSA-N |
| Molecular Formula | C10H12O3 |
3-Bromo-5-(trifluoromethyl)benzaldehyde 98.0+%, TCI America™
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CAS: 477535-41-4 Molecular Formula: C8H4BrF3O Molecular Weight (g/mol): 253.02 MDL Number: MFCD08059506 InChI Key: PCRLZGCXLNNMFL-UHFFFAOYSA-N Synonym: 3-bromo-5-trifluoromethyl benzaldehyde,benzaldehyde, 3-bromo-5-trifluoromethyl,3-trifluoromethyl-5-bromobenzaldehyde,3-bromo-5-trifluoromethyl-benzaldehyde,pubchem16131,acmc-209kad,ksc496e1r,3-bromo-5-formylbenzotrifluoride,5-bromo-3-trifluoromethyl benzaldehyde PubChem CID: 16115438 IUPAC Name: 3-bromo-5-(trifluoromethyl)benzaldehyde SMILES: FC(F)(F)C1=CC(Br)=CC(C=O)=C1
| PubChem CID | 16115438 |
|---|---|
| CAS | 477535-41-4 |
| Molecular Weight (g/mol) | 253.02 |
| MDL Number | MFCD08059506 |
| SMILES | FC(F)(F)C1=CC(Br)=CC(C=O)=C1 |
| Synonym | 3-bromo-5-trifluoromethyl benzaldehyde,benzaldehyde, 3-bromo-5-trifluoromethyl,3-trifluoromethyl-5-bromobenzaldehyde,3-bromo-5-trifluoromethyl-benzaldehyde,pubchem16131,acmc-209kad,ksc496e1r,3-bromo-5-formylbenzotrifluoride,5-bromo-3-trifluoromethyl benzaldehyde |
| IUPAC Name | 3-bromo-5-(trifluoromethyl)benzaldehyde |
| InChI Key | PCRLZGCXLNNMFL-UHFFFAOYSA-N |
| Molecular Formula | C8H4BrF3O |
Monosodium 2-Sulfoterephthalate 98.0+%, TCI America™
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CAS: 19089-60-2 Molecular Formula: C8H5NaO7S Molecular Weight (g/mol): 268.171 MDL Number: MFCD00059843 InChI Key: JARIJYUQOKFVAJ-UHFFFAOYSA-M Synonym: 2-Sulfoterephthalic Acid Monosodium Salt PubChem CID: 44630481 IUPAC Name: sodium;4-carboxy-2-sulfobenzoate SMILES: C1=CC(=C(C=C1C(=O)O)S(=O)(=O)O)C(=O)[O-].[Na+]
| PubChem CID | 44630481 |
|---|---|
| CAS | 19089-60-2 |
| Molecular Weight (g/mol) | 268.171 |
| MDL Number | MFCD00059843 |
| SMILES | C1=CC(=C(C=C1C(=O)O)S(=O)(=O)O)C(=O)[O-].[Na+] |
| Synonym | 2-Sulfoterephthalic Acid Monosodium Salt |
| IUPAC Name | sodium;4-carboxy-2-sulfobenzoate |
| InChI Key | JARIJYUQOKFVAJ-UHFFFAOYSA-M |
| Molecular Formula | C8H5NaO7S |
4-Chloro-3-methylaniline 98.0+%, TCI America™
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CAS: 7149-75-9 Molecular Formula: C7H8ClN Molecular Weight (g/mol): 141.598 MDL Number: MFCD00066332 InChI Key: HIHCTGNZNHSZPP-UHFFFAOYSA-N Synonym: 5-amino-2-chlorotoluene,benzenamine, 4-chloro-3-methyl,m-toluidine, 4-chloro,3-methyl-4-chloroaniline,4-chloro-m-toluidine,unii-6q2w6l7bwz,6q2w6l7bwz,4-chloro-3-methylphenylamine,4-chloro-3-methyl-phenylamine,4-chloro-3-methylphenyl amine PubChem CID: 23536 IUPAC Name: 4-chloro-3-methylaniline SMILES: CC1=C(C=CC(=C1)N)Cl
| PubChem CID | 23536 |
|---|---|
| CAS | 7149-75-9 |
| Molecular Weight (g/mol) | 141.598 |
| MDL Number | MFCD00066332 |
| SMILES | CC1=C(C=CC(=C1)N)Cl |
| Synonym | 5-amino-2-chlorotoluene,benzenamine, 4-chloro-3-methyl,m-toluidine, 4-chloro,3-methyl-4-chloroaniline,4-chloro-m-toluidine,unii-6q2w6l7bwz,6q2w6l7bwz,4-chloro-3-methylphenylamine,4-chloro-3-methyl-phenylamine,4-chloro-3-methylphenyl amine |
| IUPAC Name | 4-chloro-3-methylaniline |
| InChI Key | HIHCTGNZNHSZPP-UHFFFAOYSA-N |
| Molecular Formula | C7H8ClN |
3,4-Dichlorobenzyl Cyanide 98.0+%, TCI America™
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CAS: 3218-49-3 Molecular Formula: C8H5Cl2N Molecular Weight (g/mol): 186.04 MDL Number: MFCD00001909 InChI Key: QWZNCAFWRZZJMA-UHFFFAOYSA-N Synonym: 3,4-dichlorophenylacetonitrile,2-3,4-dichlorophenyl acetonitrile,3,4-dichlorobenzyl cyanide,3,4-dichlorophenyl acetonitrile,benzeneacetonitrile, 3,4-dichloro,3,4-dichlorobenzeneacetonitrile,2-3,4-dichlorophenyl ethanenitrile,3,4-dichlorphenyl acetonitrile,pubchem16506,3,4-dichlorobenzylcyanide PubChem CID: 76690 IUPAC Name: 2-(3,4-dichlorophenyl)acetonitrile SMILES: ClC1=CC=C(CC#N)C=C1Cl
| PubChem CID | 76690 |
|---|---|
| CAS | 3218-49-3 |
| Molecular Weight (g/mol) | 186.04 |
| MDL Number | MFCD00001909 |
| SMILES | ClC1=CC=C(CC#N)C=C1Cl |
| Synonym | 3,4-dichlorophenylacetonitrile,2-3,4-dichlorophenyl acetonitrile,3,4-dichlorobenzyl cyanide,3,4-dichlorophenyl acetonitrile,benzeneacetonitrile, 3,4-dichloro,3,4-dichlorobenzeneacetonitrile,2-3,4-dichlorophenyl ethanenitrile,3,4-dichlorphenyl acetonitrile,pubchem16506,3,4-dichlorobenzylcyanide |
| IUPAC Name | 2-(3,4-dichlorophenyl)acetonitrile |
| InChI Key | QWZNCAFWRZZJMA-UHFFFAOYSA-N |
| Molecular Formula | C8H5Cl2N |
alpha,alpha'-Dichloro-p-xylene 98.0+%, TCI America™
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CAS: 623-25-6 Molecular Formula: C8H8Cl2 Molecular Weight (g/mol): 175.052 MDL Number: MFCD00000920 InChI Key: ZZHIDJWUJRKHGX-UHFFFAOYSA-N Synonym: 1,4-bis chloromethyl benzene,alpha,alpha'-dichloro-p-xylene,p-xylylene dichloride,p-xylylene chloride,benzene, 1,4-bis chloromethyl,p-bis chloromethyl benzene,benzene, p-bis chloromethyl,a,a'-dichloro-p-xylene,xylylene dichloride,ccris 1772 PubChem CID: 12171 IUPAC Name: 1,4-bis(chloromethyl)benzene SMILES: C1=CC(=CC=C1CCl)CCl
| PubChem CID | 12171 |
|---|---|
| CAS | 623-25-6 |
| Molecular Weight (g/mol) | 175.052 |
| MDL Number | MFCD00000920 |
| SMILES | C1=CC(=CC=C1CCl)CCl |
| Synonym | 1,4-bis chloromethyl benzene,alpha,alpha'-dichloro-p-xylene,p-xylylene dichloride,p-xylylene chloride,benzene, 1,4-bis chloromethyl,p-bis chloromethyl benzene,benzene, p-bis chloromethyl,a,a'-dichloro-p-xylene,xylylene dichloride,ccris 1772 |
| IUPAC Name | 1,4-bis(chloromethyl)benzene |
| InChI Key | ZZHIDJWUJRKHGX-UHFFFAOYSA-N |
| Molecular Formula | C8H8Cl2 |
2-(Trifluoromethyl)benzyl Chloride 98.0+%, TCI America™
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CAS: 21742-00-7 Molecular Formula: C8H6ClF3 Molecular Weight (g/mol): 194.581 MDL Number: MFCD00009920 InChI Key: BBXDMCQDLOCXRA-UHFFFAOYSA-N Synonym: 2-trifluoromethyl benzyl chloride,1-chloromethyl-2-trifluoromethyl benzene,2-trifluoromethyl benzylchloride,2-trifluoromethylbenzyl chloride,o-trifluoromethylbenzyl chloride,benzene, 1-chloromethyl-2-trifluoromethyl,alpha'-chloro-alpha,alpha,alpha-trifluoro-o-xylene,g1r bxfff,pubchem4692,acmc-209fnp PubChem CID: 89028 IUPAC Name: 1-(chloromethyl)-2-(trifluoromethyl)benzene SMILES: C1=CC=C(C(=C1)CCl)C(F)(F)F
| PubChem CID | 89028 |
|---|---|
| CAS | 21742-00-7 |
| Molecular Weight (g/mol) | 194.581 |
| MDL Number | MFCD00009920 |
| SMILES | C1=CC=C(C(=C1)CCl)C(F)(F)F |
| Synonym | 2-trifluoromethyl benzyl chloride,1-chloromethyl-2-trifluoromethyl benzene,2-trifluoromethyl benzylchloride,2-trifluoromethylbenzyl chloride,o-trifluoromethylbenzyl chloride,benzene, 1-chloromethyl-2-trifluoromethyl,alpha'-chloro-alpha,alpha,alpha-trifluoro-o-xylene,g1r bxfff,pubchem4692,acmc-209fnp |
| IUPAC Name | 1-(chloromethyl)-2-(trifluoromethyl)benzene |
| InChI Key | BBXDMCQDLOCXRA-UHFFFAOYSA-N |
| Molecular Formula | C8H6ClF3 |
Tiron Monohydrate 98.0+%, TCI America™
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CAS: 149-45-1 Molecular Formula: C6H10Na2O8S2 Molecular Weight (g/mol): 320.238 MDL Number: MFCD00007473 InChI Key: HEOKHLCODUWALT-UHFFFAOYSA-N Synonym: tiron,tiferron,sodium catechol sulfate,disodium 4,5-dihydroxybenzene-1,3-disulfonate,3,5-disulfocatechol disodium salt,sodium pyrocatechol-3,5-disulfonate,disodium pyrocatechol-3,5-disulfonate,sodium 1,2-dihydroxybenzenedisulfonate,1,2-dihydroxybenzene-3,5-disulfonic acid disodium salt,1,3-benzenedisulfonic acid, 4,5-dihydroxy-, disodium salt PubChem CID: 131674010 IUPAC Name: 4,5-dihydroxybenzene-1,3-disulfonic acid;molecular hydrogen;sodium SMILES: [HH].[HH].C1=C(C=C(C(=C1S(=O)(=O)O)O)O)S(=O)(=O)O.[Na].[Na]
| PubChem CID | 131674010 |
|---|---|
| CAS | 149-45-1 |
| Molecular Weight (g/mol) | 320.238 |
| MDL Number | MFCD00007473 |
| SMILES | [HH].[HH].C1=C(C=C(C(=C1S(=O)(=O)O)O)O)S(=O)(=O)O.[Na].[Na] |
| Synonym | tiron,tiferron,sodium catechol sulfate,disodium 4,5-dihydroxybenzene-1,3-disulfonate,3,5-disulfocatechol disodium salt,sodium pyrocatechol-3,5-disulfonate,disodium pyrocatechol-3,5-disulfonate,sodium 1,2-dihydroxybenzenedisulfonate,1,2-dihydroxybenzene-3,5-disulfonic acid disodium salt,1,3-benzenedisulfonic acid, 4,5-dihydroxy-, disodium salt |
| IUPAC Name | 4,5-dihydroxybenzene-1,3-disulfonic acid;molecular hydrogen;sodium |
| InChI Key | HEOKHLCODUWALT-UHFFFAOYSA-N |
| Molecular Formula | C6H10Na2O8S2 |
4-Fluoro-N-methylbenzylamine 97.0+%, TCI America™
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CAS: 405-66-3 Molecular Formula: C8H10FN Molecular Weight (g/mol): 139.173 MDL Number: MFCD03839848 InChI Key: SZJIQLSCDIEJFC-UHFFFAOYSA-N Synonym: n-methyl-4-fluorobenzylamine,4-fluoro-n-methylbenzylamine,4-fluoro-benzyl-methyl-amine,1-4-fluorophenyl-n-methylmethanamine,n-4-fluorobenzyl-n-methylamine,4-fluoro-n-methyl benzylamine,4-fluorophenyl methyl methyl amine,benzenemethanamine, 4-fluoro-n-methyl,1-4-fluorophenyl-n-methyl-methanamine,acmc-1aek3 PubChem CID: 736860 IUPAC Name: 1-(4-fluorophenyl)-N-methylmethanamine SMILES: CNCC1=CC=C(C=C1)F
| PubChem CID | 736860 |
|---|---|
| CAS | 405-66-3 |
| Molecular Weight (g/mol) | 139.173 |
| MDL Number | MFCD03839848 |
| SMILES | CNCC1=CC=C(C=C1)F |
| Synonym | n-methyl-4-fluorobenzylamine,4-fluoro-n-methylbenzylamine,4-fluoro-benzyl-methyl-amine,1-4-fluorophenyl-n-methylmethanamine,n-4-fluorobenzyl-n-methylamine,4-fluoro-n-methyl benzylamine,4-fluorophenyl methyl methyl amine,benzenemethanamine, 4-fluoro-n-methyl,1-4-fluorophenyl-n-methyl-methanamine,acmc-1aek3 |
| IUPAC Name | 1-(4-fluorophenyl)-N-methylmethanamine |
| InChI Key | SZJIQLSCDIEJFC-UHFFFAOYSA-N |
| Molecular Formula | C8H10FN |
2-Fluoro-6-iodobenzonitrile 98.0+%, TCI America™
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CAS: 79544-29-9 Molecular Formula: C7H3FIN Molecular Weight (g/mol): 247.01 MDL Number: MFCD00015478 InChI Key: FAACTMVXBNSPJA-UHFFFAOYSA-N Synonym: 2-iodo-6-fluorobenzonitrile,2-cyano-3-fluoro-1-iodobenzene,benzonitrile, 2-fluoro-6-iodo,6-fluoro-2-iodobenzenecarbonitrile,2-fluoro-6-iodo-benzonitrile,6-iodo-2-fluorobenzonitrile,pubchem4780,acmc-209php,ksc494e4h,pharmabridge p-2313 PubChem CID: 522722 IUPAC Name: 2-fluoro-6-iodobenzonitrile SMILES: FC1=CC=CC(I)=C1C#N
| PubChem CID | 522722 |
|---|---|
| CAS | 79544-29-9 |
| Molecular Weight (g/mol) | 247.01 |
| MDL Number | MFCD00015478 |
| SMILES | FC1=CC=CC(I)=C1C#N |
| Synonym | 2-iodo-6-fluorobenzonitrile,2-cyano-3-fluoro-1-iodobenzene,benzonitrile, 2-fluoro-6-iodo,6-fluoro-2-iodobenzenecarbonitrile,2-fluoro-6-iodo-benzonitrile,6-iodo-2-fluorobenzonitrile,pubchem4780,acmc-209php,ksc494e4h,pharmabridge p-2313 |
| IUPAC Name | 2-fluoro-6-iodobenzonitrile |
| InChI Key | FAACTMVXBNSPJA-UHFFFAOYSA-N |
| Molecular Formula | C7H3FIN |
1,2,4,5-Tetrakis(tert-butylthio)benzene 98.0+%, TCI America™
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CAS: 447463-65-2 Molecular Formula: C22H38S4 Molecular Weight (g/mol): 430.786 InChI Key: LOCUYYPERSWXJI-UHFFFAOYSA-N PubChem CID: 11812054 IUPAC Name: 1,2,4,5-tetrakis(tert-butylsulfanyl)benzene SMILES: CC(C)(C)SC1=CC(=C(C=C1SC(C)(C)C)SC(C)(C)C)SC(C)(C)C
| PubChem CID | 11812054 |
|---|---|
| CAS | 447463-65-2 |
| Molecular Weight (g/mol) | 430.786 |
| SMILES | CC(C)(C)SC1=CC(=C(C=C1SC(C)(C)C)SC(C)(C)C)SC(C)(C)C |
| IUPAC Name | 1,2,4,5-tetrakis(tert-butylsulfanyl)benzene |
| InChI Key | LOCUYYPERSWXJI-UHFFFAOYSA-N |
| Molecular Formula | C22H38S4 |
3,4-Dichlorobenzoic Acid 98.0+%, TCI America™
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4-Methoxyphenylphosphonic Dichloride 90.0+%, TCI America™
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CAS: 37632-18-1 Molecular Formula: C7H7Cl2O2P Molecular Weight (g/mol): 225.00 MDL Number: MFCD00123296 InChI Key: LOFIFCKKPQFWSH-UHFFFAOYSA-N Synonym: 4-Dichlorophosphonylanisole PubChem CID: 216711 IUPAC Name: (4-methoxyphenyl)phosphonoyl dichloride SMILES: COC1=CC=C(C=C1)P(Cl)(Cl)=O
| PubChem CID | 216711 |
|---|---|
| CAS | 37632-18-1 |
| Molecular Weight (g/mol) | 225.00 |
| MDL Number | MFCD00123296 |
| SMILES | COC1=CC=C(C=C1)P(Cl)(Cl)=O |
| Synonym | 4-Dichlorophosphonylanisole |
| IUPAC Name | (4-methoxyphenyl)phosphonoyl dichloride |
| InChI Key | LOFIFCKKPQFWSH-UHFFFAOYSA-N |
| Molecular Formula | C7H7Cl2O2P |