Benzenoids
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4-Butylphenol 96.0+%, TCI America™
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CAS: 1638-22-8 Molecular Formula: C10H14O Molecular Weight (g/mol): 150.221 MDL Number: MFCD00041750 InChI Key: CYYZDBDROVLTJU-UHFFFAOYSA-N Synonym: 4-n-butylphenol,p-butylphenol,phenol, 4-butyl,p-hydroxybutylbenzene,phenol, p-butyl,1-hydroxy-4-n-butylbenzene,p-n-butylphenol,4-butyl-phenol,4-n-ethylphenol PubChem CID: 15420 ChEBI: CHEBI:34437 IUPAC Name: 4-butylphenol SMILES: CCCCC1=CC=C(C=C1)O
| PubChem CID | 15420 |
|---|---|
| CAS | 1638-22-8 |
| Molecular Weight (g/mol) | 150.221 |
| ChEBI | CHEBI:34437 |
| MDL Number | MFCD00041750 |
| SMILES | CCCCC1=CC=C(C=C1)O |
| Synonym | 4-n-butylphenol,p-butylphenol,phenol, 4-butyl,p-hydroxybutylbenzene,phenol, p-butyl,1-hydroxy-4-n-butylbenzene,p-n-butylphenol,4-butyl-phenol,4-n-ethylphenol |
| IUPAC Name | 4-butylphenol |
| InChI Key | CYYZDBDROVLTJU-UHFFFAOYSA-N |
| Molecular Formula | C10H14O |
2-Mesitylenesulfonyl Hydrazide 97.0+%, TCI America™
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CAS: 16182-15-3 Molecular Formula: C9H14N2O2S Molecular Weight (g/mol): 214.283 MDL Number: MFCD00007585 InChI Key: JQUBKTQDNVZHIY-UHFFFAOYSA-N Synonym: 2,4,6-trimethylbenzenesulfonyl hydrazide,mesitylene-2-sulphonohydrazide,2-mesitylenesulfonyl hydrazide,2-mesitylenesulfonohydrazide,2-mesitylenesulfono hydrazide,benzenesulfonic acid,2,4,6-trimethyl-, hydrazide,hydrazino 2,4,6-trimethylphenyl sulfone,mesitylenesulphonohydrazide,mesitylenesulfonylhydrazide,2-mesitylehesulfonohydrazide PubChem CID: 85321 IUPAC Name: 2,4,6-trimethylbenzenesulfonohydrazide SMILES: CC1=CC(=C(C(=C1)C)S(=O)(=O)NN)C
| PubChem CID | 85321 |
|---|---|
| CAS | 16182-15-3 |
| Molecular Weight (g/mol) | 214.283 |
| MDL Number | MFCD00007585 |
| SMILES | CC1=CC(=C(C(=C1)C)S(=O)(=O)NN)C |
| Synonym | 2,4,6-trimethylbenzenesulfonyl hydrazide,mesitylene-2-sulphonohydrazide,2-mesitylenesulfonyl hydrazide,2-mesitylenesulfonohydrazide,2-mesitylenesulfono hydrazide,benzenesulfonic acid,2,4,6-trimethyl-, hydrazide,hydrazino 2,4,6-trimethylphenyl sulfone,mesitylenesulphonohydrazide,mesitylenesulfonylhydrazide,2-mesitylehesulfonohydrazide |
| IUPAC Name | 2,4,6-trimethylbenzenesulfonohydrazide |
| InChI Key | JQUBKTQDNVZHIY-UHFFFAOYSA-N |
| Molecular Formula | C9H14N2O2S |
2,4,5-Trifluoroaniline 98.0+%, TCI America™
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CAS: 367-34-0 Molecular Formula: C6H4F3N Molecular Weight (g/mol): 147.1 MDL Number: MFCD00007649 InChI Key: QMYVWJVVVMIBMM-UHFFFAOYSA-N Synonym: 2,4,5-trifluorophenylamine,benzenamine, 2,4,5-trifluoro,pubchem2469,2,4,5-triflouroaniline,2,4,5-trifloro aniline,acmc-1cs4m,2,4,5-trifluoro-aniline,2,4,5-trifluoro aniline,ksc497k9p,2,4,5-trifluoro-phenylamine PubChem CID: 94953 IUPAC Name: 2,4,5-trifluoroaniline SMILES: C1=C(C(=CC(=C1F)F)F)N
| PubChem CID | 94953 |
|---|---|
| CAS | 367-34-0 |
| Molecular Weight (g/mol) | 147.1 |
| MDL Number | MFCD00007649 |
| SMILES | C1=C(C(=CC(=C1F)F)F)N |
| Synonym | 2,4,5-trifluorophenylamine,benzenamine, 2,4,5-trifluoro,pubchem2469,2,4,5-triflouroaniline,2,4,5-trifloro aniline,acmc-1cs4m,2,4,5-trifluoro-aniline,2,4,5-trifluoro aniline,ksc497k9p,2,4,5-trifluoro-phenylamine |
| IUPAC Name | 2,4,5-trifluoroaniline |
| InChI Key | QMYVWJVVVMIBMM-UHFFFAOYSA-N |
| Molecular Formula | C6H4F3N |
Thiamphenicol 98.0+%, TCI America™
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CAS: 15318-45-3 Molecular Formula: C12H15Cl2NO5S Molecular Weight (g/mol): 356.214 MDL Number: MFCD00467983 InChI Key: OTVAEFIXJLOWRX-NXEZZACHSA-N Synonym: thiamphenicol,thiophenicol,thiamcol,+-thiamphenicol,raceophenidol,thiocymetin,dextrosulphenidol,thiamphenicolum,d-thiocymetin,d-thiophenicol PubChem CID: 27200 ChEBI: CHEBI:32215 IUPAC Name: 2,2-dichloro-N-[(1R,2R)-1,3-dihydroxy-1-(4-methylsulfonylphenyl)propan-2-yl]acetamide SMILES: CS(=O)(=O)C1=CC=C(C=C1)C(C(CO)NC(=O)C(Cl)Cl)O
| PubChem CID | 27200 |
|---|---|
| CAS | 15318-45-3 |
| Molecular Weight (g/mol) | 356.214 |
| ChEBI | CHEBI:32215 |
| MDL Number | MFCD00467983 |
| SMILES | CS(=O)(=O)C1=CC=C(C=C1)C(C(CO)NC(=O)C(Cl)Cl)O |
| Synonym | thiamphenicol,thiophenicol,thiamcol,+-thiamphenicol,raceophenidol,thiocymetin,dextrosulphenidol,thiamphenicolum,d-thiocymetin,d-thiophenicol |
| IUPAC Name | 2,2-dichloro-N-[(1R,2R)-1,3-dihydroxy-1-(4-methylsulfonylphenyl)propan-2-yl]acetamide |
| InChI Key | OTVAEFIXJLOWRX-NXEZZACHSA-N |
| Molecular Formula | C12H15Cl2NO5S |
2,3,4,6-Tetra-O-benzyl-beta-D-glucopyranosyl Fluoride 96.0+%, TCI America™
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CAS: 78153-79-4 Molecular Formula: C34H35FO5 Molecular Weight (g/mol): 542.65 MDL Number: MFCD01862264 InChI Key: QNXIKNZDQVSBCO-UHFFFAOYNA-N PubChem CID: 10886059 IUPAC Name: 3,4,5-tris(benzyloxy)-2-[(benzyloxy)methyl]-6-fluorooxane SMILES: FC1OC(COCC2=CC=CC=C2)C(OCC2=CC=CC=C2)C(OCC2=CC=CC=C2)C1OCC1=CC=CC=C1
| PubChem CID | 10886059 |
|---|---|
| CAS | 78153-79-4 |
| Molecular Weight (g/mol) | 542.65 |
| MDL Number | MFCD01862264 |
| SMILES | FC1OC(COCC2=CC=CC=C2)C(OCC2=CC=CC=C2)C(OCC2=CC=CC=C2)C1OCC1=CC=CC=C1 |
| IUPAC Name | 3,4,5-tris(benzyloxy)-2-[(benzyloxy)methyl]-6-fluorooxane |
| InChI Key | QNXIKNZDQVSBCO-UHFFFAOYNA-N |
| Molecular Formula | C34H35FO5 |
1-Iodo-2-(trifluoromethoxy)benzene 98.0+%, TCI America™
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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 |
2,4,5-Trimethylbenzaldehyde 97.0+%, TCI America™
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CAS: 5779-72-6 Molecular Formula: C10H12O Molecular Weight (g/mol): 148.21 MDL Number: MFCD00017713 InChI Key: LROJZZICACKNJL-UHFFFAOYSA-N PubChem CID: 22013 IUPAC Name: 2,4,5-trimethylbenzaldehyde SMILES: CC1=CC(C)=C(C=O)C=C1C
| PubChem CID | 22013 |
|---|---|
| CAS | 5779-72-6 |
| Molecular Weight (g/mol) | 148.21 |
| MDL Number | MFCD00017713 |
| SMILES | CC1=CC(C)=C(C=O)C=C1C |
| IUPAC Name | 2,4,5-trimethylbenzaldehyde |
| InChI Key | LROJZZICACKNJL-UHFFFAOYSA-N |
| Molecular Formula | C10H12O |
Dinitrodurene 97.0+%, TCI America™
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CAS: 5465-13-4 Molecular Formula: C10H12N2O4 Molecular Weight (g/mol): 224.216 MDL Number: MFCD00007164 InChI Key: AEPQXGFMAZTUEA-UHFFFAOYSA-N Synonym: 1,2,4,5-tetramethyl-3,6-dinitro-benzene,dinitrotrodurene,3,2,4,5-tetramethylbenzene,2,3,5,6-tetramethyl-p-dinitrobenzene,1,4,5-tetramethyl-3,6-dinitrobenzene,benzene,2,4,5-tetramethyl-3,6-dinitro,1,4-dinitro-2,3,5,6-tetramethylbenzene 97+% PubChem CID: 79593 IUPAC Name: 1,2,4,5-tetramethyl-3,6-dinitrobenzene SMILES: CC1=C(C(=C(C(=C1[N+](=O)[O-])C)C)[N+](=O)[O-])C
| PubChem CID | 79593 |
|---|---|
| CAS | 5465-13-4 |
| Molecular Weight (g/mol) | 224.216 |
| MDL Number | MFCD00007164 |
| SMILES | CC1=C(C(=C(C(=C1[N+](=O)[O-])C)C)[N+](=O)[O-])C |
| Synonym | 1,2,4,5-tetramethyl-3,6-dinitro-benzene,dinitrotrodurene,3,2,4,5-tetramethylbenzene,2,3,5,6-tetramethyl-p-dinitrobenzene,1,4,5-tetramethyl-3,6-dinitrobenzene,benzene,2,4,5-tetramethyl-3,6-dinitro,1,4-dinitro-2,3,5,6-tetramethylbenzene 97+% |
| IUPAC Name | 1,2,4,5-tetramethyl-3,6-dinitrobenzene |
| InChI Key | AEPQXGFMAZTUEA-UHFFFAOYSA-N |
| Molecular Formula | C10H12N2O4 |
1-Benzyl-3-acetamidopyrrolidine 98.0+%, TCI America™
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CAS: 28506-01-6 Molecular Formula: C13H18N2O Molecular Weight (g/mol): 218.3 MDL Number: MFCD00059037 InChI Key: CMSWETNAAPYFSH-UHFFFAOYSA-N Synonym: 3-Acetamido-1-benzylpyrrolidine PubChem CID: 4198339 IUPAC Name: N-(1-benzylpyrrolidin-3-yl)acetamide SMILES: CC(=O)NC1CCN(C1)CC2=CC=CC=C2
| PubChem CID | 4198339 |
|---|---|
| CAS | 28506-01-6 |
| Molecular Weight (g/mol) | 218.3 |
| MDL Number | MFCD00059037 |
| SMILES | CC(=O)NC1CCN(C1)CC2=CC=CC=C2 |
| Synonym | 3-Acetamido-1-benzylpyrrolidine |
| IUPAC Name | N-(1-benzylpyrrolidin-3-yl)acetamide |
| InChI Key | CMSWETNAAPYFSH-UHFFFAOYSA-N |
| Molecular Formula | C13H18N2O |
5-Amino-2-nitrobenzotrifluoride 98.0+%, TCI America™
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CAS: 393-11-3 Molecular Formula: C7H5F3N2O2 Molecular Weight (g/mol): 206.12 MDL Number: MFCD00014717 InChI Key: UTKUVRNVYFTEHF-UHFFFAOYSA-N Synonym: 4-nitro-3-trifluoromethyl aniline,5-amino-2-nitrobenzotrifluoride,3-amino-6-nitrobenzotrifluoride,benzenamine, 4-nitro-3-trifluoromethyl,3-trifluoromethyl-4-nitroaniline,2-nitro-5-amino benzotrifluoride,3-trifluoromethyl-4-nitroanilide,flu-1,3-amino-6-nitro benzotrifluoride PubChem CID: 94955 IUPAC Name: 4-nitro-3-(trifluoromethyl)aniline SMILES: NC1=CC=C(C(=C1)C(F)(F)F)[N+]([O-])=O
| PubChem CID | 94955 |
|---|---|
| CAS | 393-11-3 |
| Molecular Weight (g/mol) | 206.12 |
| MDL Number | MFCD00014717 |
| SMILES | NC1=CC=C(C(=C1)C(F)(F)F)[N+]([O-])=O |
| Synonym | 4-nitro-3-trifluoromethyl aniline,5-amino-2-nitrobenzotrifluoride,3-amino-6-nitrobenzotrifluoride,benzenamine, 4-nitro-3-trifluoromethyl,3-trifluoromethyl-4-nitroaniline,2-nitro-5-amino benzotrifluoride,3-trifluoromethyl-4-nitroanilide,flu-1,3-amino-6-nitro benzotrifluoride |
| IUPAC Name | 4-nitro-3-(trifluoromethyl)aniline |
| InChI Key | UTKUVRNVYFTEHF-UHFFFAOYSA-N |
| Molecular Formula | C7H5F3N2O2 |
4,4'-Dichlorobenzophenone 99.0+%, TCI America™
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CAS: 90-98-2 Molecular Formula: C13H8Cl2O Molecular Weight (g/mol): 251.11 MDL Number: MFCD00000623 InChI Key: OKISUZLXOYGIFP-UHFFFAOYSA-N Synonym: 4,4'-dichlorobenzophenone,bis 4-chlorophenyl methanone,methanone, bis 4-chlorophenyl,bis 4-chlorophenyl ketone,dcbp,di p-chlorophenyl ketone,di 4-chlorophenyl ketone,bis p-chlorophenyl ketone,p,p'-dichlorobenzophenone,usaf do-4 PubChem CID: 7034 ChEBI: CHEBI:27519 IUPAC Name: bis(4-chlorophenyl)methanone SMILES: ClC1=CC=C(C=C1)C(=O)C1=CC=C(Cl)C=C1
| PubChem CID | 7034 |
|---|---|
| CAS | 90-98-2 |
| Molecular Weight (g/mol) | 251.11 |
| ChEBI | CHEBI:27519 |
| MDL Number | MFCD00000623 |
| SMILES | ClC1=CC=C(C=C1)C(=O)C1=CC=C(Cl)C=C1 |
| Synonym | 4,4'-dichlorobenzophenone,bis 4-chlorophenyl methanone,methanone, bis 4-chlorophenyl,bis 4-chlorophenyl ketone,dcbp,di p-chlorophenyl ketone,di 4-chlorophenyl ketone,bis p-chlorophenyl ketone,p,p'-dichlorobenzophenone,usaf do-4 |
| IUPAC Name | bis(4-chlorophenyl)methanone |
| InChI Key | OKISUZLXOYGIFP-UHFFFAOYSA-N |
| Molecular Formula | C13H8Cl2O |
3,4-Difluorobenzophenone 98.0+%, TCI America™
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CAS: 85118-07-6 Molecular Formula: C13H8F2O Molecular Weight (g/mol): 218.203 MDL Number: MFCD00009892 InChI Key: ZJTYHSBOZAQQGF-UHFFFAOYSA-N Synonym: 3,4-difluorobenzophenone,3,4-difluorophenyl phenyl methanone,methanone, 3,4-difluorophenyl phenyl,3,4-difluoro-phenyl-phenyl-methanone,3,4-difluorophenyl phenyl ketone,fr bf dvr,pubchem4220,acmc-209q4q,timtec-bb sbb016583 PubChem CID: 569908 IUPAC Name: (3,4-difluorophenyl)-phenylmethanone SMILES: C1=CC=C(C=C1)C(=O)C2=CC(=C(C=C2)F)F
| PubChem CID | 569908 |
|---|---|
| CAS | 85118-07-6 |
| Molecular Weight (g/mol) | 218.203 |
| MDL Number | MFCD00009892 |
| SMILES | C1=CC=C(C=C1)C(=O)C2=CC(=C(C=C2)F)F |
| Synonym | 3,4-difluorobenzophenone,3,4-difluorophenyl phenyl methanone,methanone, 3,4-difluorophenyl phenyl,3,4-difluoro-phenyl-phenyl-methanone,3,4-difluorophenyl phenyl ketone,fr bf dvr,pubchem4220,acmc-209q4q,timtec-bb sbb016583 |
| IUPAC Name | (3,4-difluorophenyl)-phenylmethanone |
| InChI Key | ZJTYHSBOZAQQGF-UHFFFAOYSA-N |
| Molecular Formula | C13H8F2O |
1,4-Difluoro-2-iodobenzene 98.0+%, TCI America™
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9,9-Di-n-octylfluorene-2,7-dicarboxaldehyde 98.0+%, TCI America™
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CAS: 380600-91-9 Molecular Formula: C31H42O2 Molecular Weight (g/mol): 446.675 InChI Key: ZVQJNVBHJBLVSX-UHFFFAOYSA-N PubChem CID: 53427856 IUPAC Name: 9,9-dioctylfluorene-2,7-dicarbaldehyde SMILES: CCCCCCCCC1(C2=C(C=CC(=C2)C=O)C3=C1C=C(C=C3)C=O)CCCCCCCC
| PubChem CID | 53427856 |
|---|---|
| CAS | 380600-91-9 |
| Molecular Weight (g/mol) | 446.675 |
| SMILES | CCCCCCCCC1(C2=C(C=CC(=C2)C=O)C3=C1C=C(C=C3)C=O)CCCCCCCC |
| IUPAC Name | 9,9-dioctylfluorene-2,7-dicarbaldehyde |
| InChI Key | ZVQJNVBHJBLVSX-UHFFFAOYSA-N |
| Molecular Formula | C31H42O2 |
Sodium 3-[Ethyl(m-tolyl)amino]-2-hydroxy-1-propanesulfonate Hydrate 98.0+%, TCI America™
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CAS: 82692-93-1 Molecular Formula: C12H18NNaO4S Molecular Weight (g/mol): 295.329 MDL Number: MFCD00040641 InChI Key: IRQRBVOQGUPTLG-UHFFFAOYSA-M Synonym: toos,3-ethyl m-tolyl amino-2-hydroxypropane-1-sulfonic acid, sodium salt,sodium 3-n-ethyl-3-methylanilino-2-hydroxypropanesulfonate,sodium n-ethyl-n-2-hydroxy-3-sulfopropyl-m-toluidine,sodium 3-ethyl m-tolyl amino-2-hydroxypropane-1-sulfonate,sodium 3-ethyl 3-methylphenyl amino-2-hydroxypropane-1-sulfonate,3-n-ethyl-3-methylanilino-2-hydroxypropanesulfonic acid sodium salt,1-propanesulfonic acid, 3-ethyl 3-methylphenyl amino-2-hydroxy-, monosodium salt,3-ethyl 3-methylphenyl amino-2-hydroxy-1-propanesulfonic acid monosodium salt,n-ethyl-n-2-hydroxy-3-sulfopropyl-m-toluidine sodium salt PubChem CID: 23676159 IUPAC Name: sodium;3-(N-ethyl-3-methylanilino)-2-hydroxypropane-1-sulfonate SMILES: CCN(CC(CS(=O)(=O)[O-])O)C1=CC=CC(=C1)C.[Na+]
| PubChem CID | 23676159 |
|---|---|
| CAS | 82692-93-1 |
| Molecular Weight (g/mol) | 295.329 |
| MDL Number | MFCD00040641 |
| SMILES | CCN(CC(CS(=O)(=O)[O-])O)C1=CC=CC(=C1)C.[Na+] |
| Synonym | toos,3-ethyl m-tolyl amino-2-hydroxypropane-1-sulfonic acid, sodium salt,sodium 3-n-ethyl-3-methylanilino-2-hydroxypropanesulfonate,sodium n-ethyl-n-2-hydroxy-3-sulfopropyl-m-toluidine,sodium 3-ethyl m-tolyl amino-2-hydroxypropane-1-sulfonate,sodium 3-ethyl 3-methylphenyl amino-2-hydroxypropane-1-sulfonate,3-n-ethyl-3-methylanilino-2-hydroxypropanesulfonic acid sodium salt,1-propanesulfonic acid, 3-ethyl 3-methylphenyl amino-2-hydroxy-, monosodium salt,3-ethyl 3-methylphenyl amino-2-hydroxy-1-propanesulfonic acid monosodium salt,n-ethyl-n-2-hydroxy-3-sulfopropyl-m-toluidine sodium salt |
| IUPAC Name | sodium;3-(N-ethyl-3-methylanilino)-2-hydroxypropane-1-sulfonate |
| InChI Key | IRQRBVOQGUPTLG-UHFFFAOYSA-M |
| Molecular Formula | C12H18NNaO4S |