Benzenoids
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4-Chloro-3-(trifluoromethyl)phenylboronic Acid (contains varying amounts of Anhydride), TCI America™
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| Boiling Point | 236°C |
|---|---|
| PubChem CID | 2782671 |
| CAS | 176976-42-4 |
| Molecular Weight (g/mol) | 224.37 |
| MDL Number | MFCD03094999 |
| Color | White |
| Physical Form | Crystalline Powder |
| SMILES | B(C1=CC(=C(C=C1)Cl)C(F)(F)F)(O)O |
| TSCA | No |
| IUPAC Name | [4-chloro-3-(trifluoromethyl)phenyl]boronic acid |
| InChI Key | XHKNQBNGLMOTDB-UHFFFAOYSA-N |
| Molecular Formula | C7H5BClF3O2 |
| Formula Weight | 224.37 |
N-Methyl-4-nitro-o-toluidine 97.0+%, TCI America™
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CAS: 10439-77-7 Molecular Formula: C8H10N2O2 Molecular Weight (g/mol): 166.18 MDL Number: MFCD00059083 InChI Key: NJYYBTRBCMPYCJ-UHFFFAOYSA-N Synonym: N,2-Dimethyl-4-nitroaniline, 2-(Methylamino)-5-nitrotoluene PubChem CID: 25282 IUPAC Name: N,2-dimethyl-4-nitroaniline SMILES: CNC1=CC=C(C=C1C)[N+]([O-])=O
| PubChem CID | 25282 |
|---|---|
| CAS | 10439-77-7 |
| Molecular Weight (g/mol) | 166.18 |
| MDL Number | MFCD00059083 |
| SMILES | CNC1=CC=C(C=C1C)[N+]([O-])=O |
| Synonym | N,2-Dimethyl-4-nitroaniline, 2-(Methylamino)-5-nitrotoluene |
| IUPAC Name | N,2-dimethyl-4-nitroaniline |
| InChI Key | NJYYBTRBCMPYCJ-UHFFFAOYSA-N |
| Molecular Formula | C8H10N2O2 |
Ethyl 3-Chlorobenzoate 94.0+%, TCI America™
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CAS: 1128-76-3 Molecular Formula: C9H9ClO2 Molecular Weight (g/mol): 184.619 MDL Number: MFCD00013634 InChI Key: LVFRSNCBCHABAM-UHFFFAOYSA-N Synonym: benzoic acid, 3-chloro-, ethyl ester,3-chlorobenzoic acid ethyl ester,ethyl m-chlorobenzoate,benzoic acid, m-chloro-, ethyl ester,3-chloro-benzoic acid ethyl ester,pubchem3704,acmc-1bt4u,ethyl3-chlorobenzoate,ksc495m6f,rarechem al bi 0056 PubChem CID: 70785 IUPAC Name: ethyl 3-chlorobenzoate SMILES: CCOC(=O)C1=CC(=CC=C1)Cl
| PubChem CID | 70785 |
|---|---|
| CAS | 1128-76-3 |
| Molecular Weight (g/mol) | 184.619 |
| MDL Number | MFCD00013634 |
| SMILES | CCOC(=O)C1=CC(=CC=C1)Cl |
| Synonym | benzoic acid, 3-chloro-, ethyl ester,3-chlorobenzoic acid ethyl ester,ethyl m-chlorobenzoate,benzoic acid, m-chloro-, ethyl ester,3-chloro-benzoic acid ethyl ester,pubchem3704,acmc-1bt4u,ethyl3-chlorobenzoate,ksc495m6f,rarechem al bi 0056 |
| IUPAC Name | ethyl 3-chlorobenzoate |
| InChI Key | LVFRSNCBCHABAM-UHFFFAOYSA-N |
| Molecular Formula | C9H9ClO2 |
3-Methylstyrene (stabilized with TBC) 97.0+%, TCI America™
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CAS: 100-80-1 Molecular Formula: C9H10 Molecular Weight (g/mol): 118.179 MDL Number: MFCD00008617 InChI Key: JZHGRUMIRATHIU-UHFFFAOYSA-N Synonym: 3-methylstyrene,3-vinyltoluene,1-methyl-3-vinylbenzene,m-vinyltoluene,m-methylstyrene,benzene, 1-ethenyl-3-methyl,styrene, m-methyl,m-methyl styrene,meta-methylstyrene,unii-ffk4i9430g PubChem CID: 7529 IUPAC Name: 1-ethenyl-3-methylbenzene SMILES: CC1=CC=CC(=C1)C=C
| PubChem CID | 7529 |
|---|---|
| CAS | 100-80-1 |
| Molecular Weight (g/mol) | 118.179 |
| MDL Number | MFCD00008617 |
| SMILES | CC1=CC=CC(=C1)C=C |
| Synonym | 3-methylstyrene,3-vinyltoluene,1-methyl-3-vinylbenzene,m-vinyltoluene,m-methylstyrene,benzene, 1-ethenyl-3-methyl,styrene, m-methyl,m-methyl styrene,meta-methylstyrene,unii-ffk4i9430g |
| IUPAC Name | 1-ethenyl-3-methylbenzene |
| InChI Key | JZHGRUMIRATHIU-UHFFFAOYSA-N |
| Molecular Formula | C9H10 |
Sulfaguanidine 98.0+%, TCI America™
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CAS: 57-67-0 Molecular Formula: C7H10N4O2S Molecular Weight (g/mol): 214.243 MDL Number: MFCD00038136 InChI Key: BRBKOPJOKNSWSG-UHFFFAOYSA-N Synonym: sulfaguanidine,sulphaguanidine,sulfaguanidin,guanicil,sulfaguine,aterian,sulfanilguanidine,sulfanilylguanidine,sulfoguanidine,abiguanil PubChem CID: 5324 IUPAC Name: 2-(4-aminophenyl)sulfonylguanidine SMILES: C1=CC(=CC=C1N)S(=O)(=O)N=C(N)N
| PubChem CID | 5324 |
|---|---|
| CAS | 57-67-0 |
| Molecular Weight (g/mol) | 214.243 |
| MDL Number | MFCD00038136 |
| SMILES | C1=CC(=CC=C1N)S(=O)(=O)N=C(N)N |
| Synonym | sulfaguanidine,sulphaguanidine,sulfaguanidin,guanicil,sulfaguine,aterian,sulfanilguanidine,sulfanilylguanidine,sulfoguanidine,abiguanil |
| IUPAC Name | 2-(4-aminophenyl)sulfonylguanidine |
| InChI Key | BRBKOPJOKNSWSG-UHFFFAOYSA-N |
| Molecular Formula | C7H10N4O2S |
4-Benzylamino-1-butanol 96.0+%, TCI America™
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CAS: 59578-63-1 Molecular Formula: C11H18NO Molecular Weight (g/mol): 180.27 MDL Number: MFCD00191609 InChI Key: SNRCGOVPZJPRQZ-UHFFFAOYSA-O Synonym: 4-benzylamino-1-butanol,4-benzylamino butan-1-ol,4-benzylamino-butan-1-ol,acmc-1ay6n,4-benzylamino ;butan-1-ol,n-4-hydroxybutyl benzylamine,1-butanol,4-phenylmethyl amino,1-butanol, 4-phenylmethyl amino PubChem CID: 1790018 IUPAC Name: benzyl(4-hydroxybutyl)azanium SMILES: OCCCC[NH2+]CC1=CC=CC=C1
| PubChem CID | 1790018 |
|---|---|
| CAS | 59578-63-1 |
| Molecular Weight (g/mol) | 180.27 |
| MDL Number | MFCD00191609 |
| SMILES | OCCCC[NH2+]CC1=CC=CC=C1 |
| Synonym | 4-benzylamino-1-butanol,4-benzylamino butan-1-ol,4-benzylamino-butan-1-ol,acmc-1ay6n,4-benzylamino ;butan-1-ol,n-4-hydroxybutyl benzylamine,1-butanol,4-phenylmethyl amino,1-butanol, 4-phenylmethyl amino |
| IUPAC Name | benzyl(4-hydroxybutyl)azanium |
| InChI Key | SNRCGOVPZJPRQZ-UHFFFAOYSA-O |
| Molecular Formula | C11H18NO |
2,4-Di-tert-amylphenol 98.0+%, TCI America™
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CAS: 120-95-6 Molecular Formula: C16H26O Molecular Weight (g/mol): 234.38 MDL Number: MFCD00041929 InChI Key: WMVJWKURWRGJCI-UHFFFAOYSA-N Synonym: 2,4-di-tert-pentylphenol,2,4-di-tert-amylphenol,2,4-di-t-pentylphenol,2,4-bis 1,1-dimethylpropyl phenol,phenol, 2,4-bis 1,1-dimethylpropyl,di-tert-amylphenol,prodox 156,phenol, 2,4-di-tert-pentyl,2,4-bis 2-methylbutan-2-yl phenol,unii-852f1hp88h PubChem CID: 8455 IUPAC Name: 2,4-bis(2-methylbutan-2-yl)phenol SMILES: CCC(C)(C)C1=CC=C(O)C(=C1)C(C)(C)CC
| PubChem CID | 8455 |
|---|---|
| CAS | 120-95-6 |
| Molecular Weight (g/mol) | 234.38 |
| MDL Number | MFCD00041929 |
| SMILES | CCC(C)(C)C1=CC=C(O)C(=C1)C(C)(C)CC |
| Synonym | 2,4-di-tert-pentylphenol,2,4-di-tert-amylphenol,2,4-di-t-pentylphenol,2,4-bis 1,1-dimethylpropyl phenol,phenol, 2,4-bis 1,1-dimethylpropyl,di-tert-amylphenol,prodox 156,phenol, 2,4-di-tert-pentyl,2,4-bis 2-methylbutan-2-yl phenol,unii-852f1hp88h |
| IUPAC Name | 2,4-bis(2-methylbutan-2-yl)phenol |
| InChI Key | WMVJWKURWRGJCI-UHFFFAOYSA-N |
| Molecular Formula | C16H26O |
2-Isopropylbenzoic Acid 98.0+%, TCI America™
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CAS: 2438-04-2 Molecular Formula: C10H12O2 Molecular Weight (g/mol): 164.20 MDL Number: MFCD00045836 InChI Key: BANZVKGLDQDFDV-UHFFFAOYSA-N PubChem CID: 17099 IUPAC Name: 2-propan-2-ylbenzoic acid SMILES: CC(C)C1=CC=CC=C1C(=O)O
| PubChem CID | 17099 |
|---|---|
| CAS | 2438-04-2 |
| Molecular Weight (g/mol) | 164.20 |
| MDL Number | MFCD00045836 |
| SMILES | CC(C)C1=CC=CC=C1C(=O)O |
| IUPAC Name | 2-propan-2-ylbenzoic acid |
| InChI Key | BANZVKGLDQDFDV-UHFFFAOYSA-N |
| Molecular Formula | C10H12O2 |
2-Amino-1-naphthalenesulfonic Acid 98.0+%, TCI America™
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CAS: 81-16-3 Molecular Formula: C10H9NO3S Molecular Weight (g/mol): 223.246 MDL Number: MFCD00003988 InChI Key: GWIAAIUASRVOIA-UHFFFAOYSA-N Synonym: tobias acid,2-amino-1-naphthalenesulfonic acid,2-naphthylamine-1-sulfonic acid,1-naphthalenesulfonic acid, 2-amino,kyselina tobiasova,unii-f9qkw1fce0,kyselina 2-naftylamin-1-sulfonova,kyselina tobiasova czech,ccris 9048,2-aminonaphthalene-1-sulphonic acid PubChem CID: 6670 IUPAC Name: 2-aminonaphthalene-1-sulfonic acid SMILES: C1=CC=C2C(=C1)C=CC(=C2S(=O)(=O)O)N
| PubChem CID | 6670 |
|---|---|
| CAS | 81-16-3 |
| Molecular Weight (g/mol) | 223.246 |
| MDL Number | MFCD00003988 |
| SMILES | C1=CC=C2C(=C1)C=CC(=C2S(=O)(=O)O)N |
| Synonym | tobias acid,2-amino-1-naphthalenesulfonic acid,2-naphthylamine-1-sulfonic acid,1-naphthalenesulfonic acid, 2-amino,kyselina tobiasova,unii-f9qkw1fce0,kyselina 2-naftylamin-1-sulfonova,kyselina tobiasova czech,ccris 9048,2-aminonaphthalene-1-sulphonic acid |
| IUPAC Name | 2-aminonaphthalene-1-sulfonic acid |
| InChI Key | GWIAAIUASRVOIA-UHFFFAOYSA-N |
| Molecular Formula | C10H9NO3S |
3-Hydroxyxanthen-9-one 98.0+%, TCI America™
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CAS: 3722-51-8 Molecular Formula: C13H8O3 Molecular Weight (g/mol): 212.204 MDL Number: MFCD00604748 InChI Key: XCJHDJAODLKGLG-UHFFFAOYSA-N Synonym: sieber linker,3-hydroxy-9h-xanthen-9-one,3-hydroxy-xanthen-9-one,3-hydroxyxanthone,9h-xanthen-9-one, 3-hydroxy,sieber linker;,xanthen-9-one, 3-hydroxy,pubchem12819,acmc-209irq,3-hydroxy-9-xanthenone PubChem CID: 5376013 IUPAC Name: 3-hydroxyxanthen-9-one SMILES: C1=CC=C2C(=C1)C(=O)C3=C(O2)C=C(C=C3)O
| PubChem CID | 5376013 |
|---|---|
| CAS | 3722-51-8 |
| Molecular Weight (g/mol) | 212.204 |
| MDL Number | MFCD00604748 |
| SMILES | C1=CC=C2C(=C1)C(=O)C3=C(O2)C=C(C=C3)O |
| Synonym | sieber linker,3-hydroxy-9h-xanthen-9-one,3-hydroxy-xanthen-9-one,3-hydroxyxanthone,9h-xanthen-9-one, 3-hydroxy,sieber linker;,xanthen-9-one, 3-hydroxy,pubchem12819,acmc-209irq,3-hydroxy-9-xanthenone |
| IUPAC Name | 3-hydroxyxanthen-9-one |
| InChI Key | XCJHDJAODLKGLG-UHFFFAOYSA-N |
| Molecular Formula | C13H8O3 |
9-Fluorenylmethyl Pentafluorophenyl Carbonate 98.0+%, TCI America™
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CAS: 88744-04-1 Molecular Formula: C21H11F5O3 Molecular Weight (g/mol): 406.308 MDL Number: MFCD00013261 InChI Key: CBBKZVZOEBSFQX-UHFFFAOYSA-N Synonym: 9-fluorenylmethyl pentafluorophenyl carbonate,fmoc-opfp,9h-fluoren-9-yl methyl perfluorophenyl carbonate,9h-fluoren-9-ylmethyl 2,3,4,5,6-pentafluorophenyl carbonate,9h-fluoren-9-ylmethyl pentafluorophenyl carbonate,carbonic acid 9h-fluoren-9-ylmethyl pentafluorophenyl ester,carbonic acid,9h-fluoren-9-ylmethyl 2,3,4,5,6-pentafluorophenyl ester,acmc-20ecck,fmoc pentafluorophenyl ester,9-fluorenylmethylpentafluorophenylcarbonate PubChem CID: 2733201 IUPAC Name: 9H-fluoren-9-ylmethyl (2,3,4,5,6-pentafluorophenyl) carbonate SMILES: C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)OC4=C(C(=C(C(=C4F)F)F)F)F
| PubChem CID | 2733201 |
|---|---|
| CAS | 88744-04-1 |
| Molecular Weight (g/mol) | 406.308 |
| MDL Number | MFCD00013261 |
| SMILES | C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)OC4=C(C(=C(C(=C4F)F)F)F)F |
| Synonym | 9-fluorenylmethyl pentafluorophenyl carbonate,fmoc-opfp,9h-fluoren-9-yl methyl perfluorophenyl carbonate,9h-fluoren-9-ylmethyl 2,3,4,5,6-pentafluorophenyl carbonate,9h-fluoren-9-ylmethyl pentafluorophenyl carbonate,carbonic acid 9h-fluoren-9-ylmethyl pentafluorophenyl ester,carbonic acid,9h-fluoren-9-ylmethyl 2,3,4,5,6-pentafluorophenyl ester,acmc-20ecck,fmoc pentafluorophenyl ester,9-fluorenylmethylpentafluorophenylcarbonate |
| IUPAC Name | 9H-fluoren-9-ylmethyl (2,3,4,5,6-pentafluorophenyl) carbonate |
| InChI Key | CBBKZVZOEBSFQX-UHFFFAOYSA-N |
| Molecular Formula | C21H11F5O3 |
2,6-Dibromo-p-cresol 98.0+%, TCI America™
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CAS: 2432-14-6 Molecular Formula: C7H6Br2O Molecular Weight (g/mol): 265.932 MDL Number: MFCD00002154 InChI Key: FIGPGTJKHFAYRK-UHFFFAOYSA-N Synonym: 2,6-dibromo-p-cresol,dibromocresol,p-cresol, 2,6-dibromo,3,5-dibromo-4-hydroxytoluene,phenol, 2,6-dibromo-4-methyl,2,6-dibromo-4-methyl-phenol,attercop-chm at113597,dibromopcresol,p-cresol,6-dibromo,2,6-dibromo-p-creso PubChem CID: 17078 IUPAC Name: 2,6-dibromo-4-methylphenol SMILES: CC1=CC(=C(C(=C1)Br)O)Br
| PubChem CID | 17078 |
|---|---|
| CAS | 2432-14-6 |
| Molecular Weight (g/mol) | 265.932 |
| MDL Number | MFCD00002154 |
| SMILES | CC1=CC(=C(C(=C1)Br)O)Br |
| Synonym | 2,6-dibromo-p-cresol,dibromocresol,p-cresol, 2,6-dibromo,3,5-dibromo-4-hydroxytoluene,phenol, 2,6-dibromo-4-methyl,2,6-dibromo-4-methyl-phenol,attercop-chm at113597,dibromopcresol,p-cresol,6-dibromo,2,6-dibromo-p-creso |
| IUPAC Name | 2,6-dibromo-4-methylphenol |
| InChI Key | FIGPGTJKHFAYRK-UHFFFAOYSA-N |
| Molecular Formula | C7H6Br2O |
1-(p-Toluenesulfonyl)pyrrole-2-carboxaldehyde 98.0+%, TCI America™
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CAS: 102619-05-6 Molecular Formula: C12H11NO3S Molecular Weight (g/mol): 249.28 MDL Number: MFCD00671580 InChI Key: PJJJROQSNDRWIU-UHFFFAOYSA-N Synonym: 1-(p-Toluenesulfonyl)pyrrole-2-aldehyde, 1-Tosylpyrrole-2-aldehyde, 1-Tosylpyrrole-2-carboxaldehyde PubChem CID: 5132995 IUPAC Name: 1-(4-methylbenzenesulfonyl)-1H-pyrrole-2-carbaldehyde SMILES: CC1=CC=C(C=C1)S(=O)(=O)N1C=CC=C1C=O
| PubChem CID | 5132995 |
|---|---|
| CAS | 102619-05-6 |
| Molecular Weight (g/mol) | 249.28 |
| MDL Number | MFCD00671580 |
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)N1C=CC=C1C=O |
| Synonym | 1-(p-Toluenesulfonyl)pyrrole-2-aldehyde, 1-Tosylpyrrole-2-aldehyde, 1-Tosylpyrrole-2-carboxaldehyde |
| IUPAC Name | 1-(4-methylbenzenesulfonyl)-1H-pyrrole-2-carbaldehyde |
| InChI Key | PJJJROQSNDRWIU-UHFFFAOYSA-N |
| Molecular Formula | C12H11NO3S |
5-Chloro-2-methoxyaniline 98.0+%, TCI America™
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CAS: 95-03-4 Molecular Formula: C7H8ClNO Molecular Weight (g/mol): 157.597 MDL Number: MFCD00007777 InChI Key: WBSMIPLNPSCJFS-UHFFFAOYSA-N Synonym: 2-amino-4-chloroanisole,5-chloro-o-anisidine,benzenamine, 5-chloro-2-methoxy,2-methoxy-5-chloroaniline,tulabase fast red r,tulabase fast red rc,4-chloro-2-aminoanisole,o-anisidine, 5-chloro,5-chloro-2-methoxyphenylamine,p-chloro-o-aminoanisole PubChem CID: 66763 IUPAC Name: 5-chloro-2-methoxyaniline SMILES: COC1=C(C=C(C=C1)Cl)N
| PubChem CID | 66763 |
|---|---|
| CAS | 95-03-4 |
| Molecular Weight (g/mol) | 157.597 |
| MDL Number | MFCD00007777 |
| SMILES | COC1=C(C=C(C=C1)Cl)N |
| Synonym | 2-amino-4-chloroanisole,5-chloro-o-anisidine,benzenamine, 5-chloro-2-methoxy,2-methoxy-5-chloroaniline,tulabase fast red r,tulabase fast red rc,4-chloro-2-aminoanisole,o-anisidine, 5-chloro,5-chloro-2-methoxyphenylamine,p-chloro-o-aminoanisole |
| IUPAC Name | 5-chloro-2-methoxyaniline |
| InChI Key | WBSMIPLNPSCJFS-UHFFFAOYSA-N |
| Molecular Formula | C7H8ClNO |
2-Methoxyphenoxyacetic Acid 98.0+%, TCI America™
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CAS: 1878-85-9 Molecular Formula: C9H10O4 Molecular Weight (g/mol): 182.175 MDL Number: MFCD00014352 InChI Key: IHONYPFTXGQWAX-UHFFFAOYSA-N Synonym: 2-methoxyphenoxy acetic acid,2-2-methoxyphenoxy acetic acid,2-methoxyphenoxyacetic acid,guaiacoxyacetic acid,acetic acid, 2-methoxyphenoxy,o-methoxyphenoxy acetic acid,unii-7xvz1x365a,acide o-methoxyphenoxyacetique french,o-methoxy phenoxyacetic acid,acetic acid, o-methoxyphenoxy PubChem CID: 15882 IUPAC Name: 2-(2-methoxyphenoxy)acetic acid SMILES: COC1=CC=CC=C1OCC(=O)O
| PubChem CID | 15882 |
|---|---|
| CAS | 1878-85-9 |
| Molecular Weight (g/mol) | 182.175 |
| MDL Number | MFCD00014352 |
| SMILES | COC1=CC=CC=C1OCC(=O)O |
| Synonym | 2-methoxyphenoxy acetic acid,2-2-methoxyphenoxy acetic acid,2-methoxyphenoxyacetic acid,guaiacoxyacetic acid,acetic acid, 2-methoxyphenoxy,o-methoxyphenoxy acetic acid,unii-7xvz1x365a,acide o-methoxyphenoxyacetique french,o-methoxy phenoxyacetic acid,acetic acid, o-methoxyphenoxy |
| IUPAC Name | 2-(2-methoxyphenoxy)acetic acid |
| InChI Key | IHONYPFTXGQWAX-UHFFFAOYSA-N |
| Molecular Formula | C9H10O4 |