Benzenoids
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Fenofibric Acid 98.0+%, TCI America™
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CAS: 42017-89-0 Molecular Formula: C17H15ClO4 Molecular Weight (g/mol): 318.75 MDL Number: MFCD00792461 InChI Key: MQOBSOSZFYZQOK-UHFFFAOYSA-N Synonym: 2-[4-(4-Chlorobenzoyl)phenoxy]-2-methylpropionic Acid PubChem CID: 64929 ChEBI: CHEBI:83469 IUPAC Name: 2-[4-(4-chlorobenzoyl)phenoxy]-2-methylpropanoic acid SMILES: CC(C)(OC1=CC=C(C=C1)C(=O)C1=CC=C(Cl)C=C1)C(O)=O
| PubChem CID | 64929 |
|---|---|
| CAS | 42017-89-0 |
| Molecular Weight (g/mol) | 318.75 |
| ChEBI | CHEBI:83469 |
| MDL Number | MFCD00792461 |
| SMILES | CC(C)(OC1=CC=C(C=C1)C(=O)C1=CC=C(Cl)C=C1)C(O)=O |
| Synonym | 2-[4-(4-Chlorobenzoyl)phenoxy]-2-methylpropionic Acid |
| IUPAC Name | 2-[4-(4-chlorobenzoyl)phenoxy]-2-methylpropanoic acid |
| InChI Key | MQOBSOSZFYZQOK-UHFFFAOYSA-N |
| Molecular Formula | C17H15ClO4 |
4,4',4″-Trifluorotrityl Alcohol 98.0+%, TCI America™
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CAS: 379-57-7 Molecular Formula: C19H13F3O Molecular Weight (g/mol): 314.31 MDL Number: MFCD00191587 InChI Key: JALVMPWRAMMHQY-UHFFFAOYSA-N Synonym: Tris(4-fluorophenyl)methanol PubChem CID: 2778005 IUPAC Name: tris(4-fluorophenyl)methanol SMILES: OC(C1=CC=C(F)C=C1)(C1=CC=C(F)C=C1)C1=CC=C(F)C=C1
| PubChem CID | 2778005 |
|---|---|
| CAS | 379-57-7 |
| Molecular Weight (g/mol) | 314.31 |
| MDL Number | MFCD00191587 |
| SMILES | OC(C1=CC=C(F)C=C1)(C1=CC=C(F)C=C1)C1=CC=C(F)C=C1 |
| Synonym | Tris(4-fluorophenyl)methanol |
| IUPAC Name | tris(4-fluorophenyl)methanol |
| InChI Key | JALVMPWRAMMHQY-UHFFFAOYSA-N |
| Molecular Formula | C19H13F3O |
2,3-Dichlorobenzyl Alcohol 98.0+%, TCI America™
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CAS: 38594-42-2 Molecular Formula: C7H6Cl2O Molecular Weight (g/mol): 177.024 MDL Number: MFCD00238581 InChI Key: STVBVTWXWZMRPZ-UHFFFAOYSA-N PubChem CID: 228603 IUPAC Name: (2,3-dichlorophenyl)methanol SMILES: C1=CC(=C(C(=C1)Cl)Cl)CO
| PubChem CID | 228603 |
|---|---|
| CAS | 38594-42-2 |
| Molecular Weight (g/mol) | 177.024 |
| MDL Number | MFCD00238581 |
| SMILES | C1=CC(=C(C(=C1)Cl)Cl)CO |
| IUPAC Name | (2,3-dichlorophenyl)methanol |
| InChI Key | STVBVTWXWZMRPZ-UHFFFAOYSA-N |
| Molecular Formula | C7H6Cl2O |
4-Hydroxy-3,5-dimethylbenzonitrile 95.0+%, TCI America™
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CAS: 4198-90-7 Molecular Formula: C9H9NO Molecular Weight (g/mol): 147.177 MDL Number: MFCD00221716 InChI Key: WFYGXOWFEIOHCZ-UHFFFAOYSA-N Synonym: 3,5-dimethyl-4-hydroxybenzonitrile,4-cyano-2,6-dimethylphenol,2,6-dimethyl-4-cyanophenol,4-hydroxy-3,5-dimethyl-benzonitrile,3,5-dimethyl-4-hydroxy benzonitrile,benzonitrile, 3,5-dimethyl-4-hydroxy,4-hydroxy-3,5-dimethylbenzenecarbonitrile,benzonitrile, 4-hydroxy-3,5-dimethyl,pubchem11065,acmc-209jmm PubChem CID: 20176 IUPAC Name: 4-hydroxy-3,5-dimethylbenzonitrile SMILES: CC1=CC(=CC(=C1O)C)C#N
| PubChem CID | 20176 |
|---|---|
| CAS | 4198-90-7 |
| Molecular Weight (g/mol) | 147.177 |
| MDL Number | MFCD00221716 |
| SMILES | CC1=CC(=CC(=C1O)C)C#N |
| Synonym | 3,5-dimethyl-4-hydroxybenzonitrile,4-cyano-2,6-dimethylphenol,2,6-dimethyl-4-cyanophenol,4-hydroxy-3,5-dimethyl-benzonitrile,3,5-dimethyl-4-hydroxy benzonitrile,benzonitrile, 3,5-dimethyl-4-hydroxy,4-hydroxy-3,5-dimethylbenzenecarbonitrile,benzonitrile, 4-hydroxy-3,5-dimethyl,pubchem11065,acmc-209jmm |
| IUPAC Name | 4-hydroxy-3,5-dimethylbenzonitrile |
| InChI Key | WFYGXOWFEIOHCZ-UHFFFAOYSA-N |
| Molecular Formula | C9H9NO |
4,4'-Bis(diethylamino)benzophenone 98.0+%, TCI America™
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CAS: 90-93-7 Molecular Formula: C21H28N2O Molecular Weight (g/mol): 324.47 MDL Number: MFCD00009044 InChI Key: VYHBFRJRBHMIQZ-UHFFFAOYSA-N Synonym: 4,4'-bis diethylamino benzophenone,michler's ethyl ketone,bis 4-diethylamino phenyl methanone,methanone, bis 4-diethylamino phenyl,4,4'-tetraethyldiamino benzophenone,p,p'-bis diethylamino benzophenone,p,p'-tetraethyldiamino benzophenone,ethyl michler ketone PubChem CID: 66663 IUPAC Name: 4-[4-(diethylamino)benzoyl]-N,N-diethylaniline SMILES: CCN(CC)C1=CC=C(C=C1)C(=O)C1=CC=C(C=C1)N(CC)CC
| PubChem CID | 66663 |
|---|---|
| CAS | 90-93-7 |
| Molecular Weight (g/mol) | 324.47 |
| MDL Number | MFCD00009044 |
| SMILES | CCN(CC)C1=CC=C(C=C1)C(=O)C1=CC=C(C=C1)N(CC)CC |
| Synonym | 4,4'-bis diethylamino benzophenone,michler's ethyl ketone,bis 4-diethylamino phenyl methanone,methanone, bis 4-diethylamino phenyl,4,4'-tetraethyldiamino benzophenone,p,p'-bis diethylamino benzophenone,p,p'-tetraethyldiamino benzophenone,ethyl michler ketone |
| IUPAC Name | 4-[4-(diethylamino)benzoyl]-N,N-diethylaniline |
| InChI Key | VYHBFRJRBHMIQZ-UHFFFAOYSA-N |
| Molecular Formula | C21H28N2O |
3-Chloro-5-hydroxybenzonitrile 95.0+%, TCI America™
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CAS: 473923-97-6 Molecular Formula: C7H4ClNO Molecular Weight (g/mol): 153.57 MDL Number: MFCD11226540 InChI Key: GHYUOOZZOMUNSY-UHFFFAOYSA-N Synonym: 3-Chloro-5-cyanophenol PubChem CID: 21949878 IUPAC Name: 3-chloro-5-hydroxybenzonitrile SMILES: OC1=CC(Cl)=CC(=C1)C#N
| PubChem CID | 21949878 |
|---|---|
| CAS | 473923-97-6 |
| Molecular Weight (g/mol) | 153.57 |
| MDL Number | MFCD11226540 |
| SMILES | OC1=CC(Cl)=CC(=C1)C#N |
| Synonym | 3-Chloro-5-cyanophenol |
| IUPAC Name | 3-chloro-5-hydroxybenzonitrile |
| InChI Key | GHYUOOZZOMUNSY-UHFFFAOYSA-N |
| Molecular Formula | C7H4ClNO |
4-Bromophthalonitrile 97.0+%, TCI America™
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CAS: 70484-01-4 Molecular Formula: C8H3BrN2 Molecular Weight (g/mol): 207.03 MDL Number: MFCD00221794 InChI Key: ARAONWRSVQOHIT-UHFFFAOYSA-N Synonym: 4-Bromo-1,2-dicyanobenzene PubChem CID: 11356223 IUPAC Name: 4-bromobenzene-1,2-dicarbonitrile SMILES: BrC1=CC(C#N)=C(C=C1)C#N
| PubChem CID | 11356223 |
|---|---|
| CAS | 70484-01-4 |
| Molecular Weight (g/mol) | 207.03 |
| MDL Number | MFCD00221794 |
| SMILES | BrC1=CC(C#N)=C(C=C1)C#N |
| Synonym | 4-Bromo-1,2-dicyanobenzene |
| IUPAC Name | 4-bromobenzene-1,2-dicarbonitrile |
| InChI Key | ARAONWRSVQOHIT-UHFFFAOYSA-N |
| Molecular Formula | C8H3BrN2 |
1-Benzyl-3-aminopyrrolidine 97.0+%, TCI America™
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CAS: 18471-40-4 Molecular Formula: C11H16N2 Molecular Weight (g/mol): 176.263 MDL Number: MFCD00059036 InChI Key: HBVNLKQGRZPGRP-UHFFFAOYSA-N Synonym: 3-Amino-1-benzylpyrrolidine PubChem CID: 2756613 IUPAC Name: 1-benzylpyrrolidin-3-amine SMILES: C1CN(CC1N)CC2=CC=CC=C2
| PubChem CID | 2756613 |
|---|---|
| CAS | 18471-40-4 |
| Molecular Weight (g/mol) | 176.263 |
| MDL Number | MFCD00059036 |
| SMILES | C1CN(CC1N)CC2=CC=CC=C2 |
| Synonym | 3-Amino-1-benzylpyrrolidine |
| IUPAC Name | 1-benzylpyrrolidin-3-amine |
| InChI Key | HBVNLKQGRZPGRP-UHFFFAOYSA-N |
| Molecular Formula | C11H16N2 |
4-Cyanobenzoic Acid 98.0+%, TCI America™
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CAS: 619-65-8 Molecular Formula: C8H5NO2 Molecular Weight (g/mol): 147.133 MDL Number: MFCD00002528 InChI Key: ADCUEPOHPCPMCE-UHFFFAOYSA-N Synonym: p-cyanobenzoic acid,benzoic acid, 4-cyano,p-carboxybenzonitrile,4-carboxybenzonitrile,benzoic acid, p-cyano,4-cyano-benzoic acid,4-cyano benzoic acid,benzoicacid, 4-cyano,4-cyanobenzoicacid,para-cyanobenzoic acid PubChem CID: 12087 IUPAC Name: 4-cyanobenzoic acid SMILES: C1=CC(=CC=C1C#N)C(=O)O
| PubChem CID | 12087 |
|---|---|
| CAS | 619-65-8 |
| Molecular Weight (g/mol) | 147.133 |
| MDL Number | MFCD00002528 |
| SMILES | C1=CC(=CC=C1C#N)C(=O)O |
| Synonym | p-cyanobenzoic acid,benzoic acid, 4-cyano,p-carboxybenzonitrile,4-carboxybenzonitrile,benzoic acid, p-cyano,4-cyano-benzoic acid,4-cyano benzoic acid,benzoicacid, 4-cyano,4-cyanobenzoicacid,para-cyanobenzoic acid |
| IUPAC Name | 4-cyanobenzoic acid |
| InChI Key | ADCUEPOHPCPMCE-UHFFFAOYSA-N |
| Molecular Formula | C8H5NO2 |
Cloquintocet-mexyl 98.0+%, TCI America™
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CAS: 99607-70-2 Molecular Formula: C18H22ClNO3 Molecular Weight (g/mol): 335.83 MDL Number: MFCD01632329 InChI Key: COYBRKAVBMYYSF-UHFFFAOYNA-N Synonym: cloquintocet-mexyl,1-methylhexyl 5-chloroquinolin-8-yloxy acetate,cloquintocet-mexyl iso,cloquintocet mexyl,cloquintocet-1-methylhexyl ester,heptan-2-yl 2-5-chloroquinolin-8-yl oxyacetate,heptan-2-yl 2-5-chloroquinolin-8-yl oxy acetate,acetic acid, 5-chloro-8-quinolinyl oxy-, 1-methylhexyl ester,rs-1-methylhexyl 5-chloroquinolin-8-yloxy acetate PubChem CID: 93528 IUPAC Name: heptan-2-yl 2-[(5-chloroquinolin-8-yl)oxy]acetate SMILES: CCCCCC(C)OC(=O)COC1=C2N=CC=CC2=C(Cl)C=C1
| PubChem CID | 93528 |
|---|---|
| CAS | 99607-70-2 |
| Molecular Weight (g/mol) | 335.83 |
| MDL Number | MFCD01632329 |
| SMILES | CCCCCC(C)OC(=O)COC1=C2N=CC=CC2=C(Cl)C=C1 |
| Synonym | cloquintocet-mexyl,1-methylhexyl 5-chloroquinolin-8-yloxy acetate,cloquintocet-mexyl iso,cloquintocet mexyl,cloquintocet-1-methylhexyl ester,heptan-2-yl 2-5-chloroquinolin-8-yl oxyacetate,heptan-2-yl 2-5-chloroquinolin-8-yl oxy acetate,acetic acid, 5-chloro-8-quinolinyl oxy-, 1-methylhexyl ester,rs-1-methylhexyl 5-chloroquinolin-8-yloxy acetate |
| IUPAC Name | heptan-2-yl 2-[(5-chloroquinolin-8-yl)oxy]acetate |
| InChI Key | COYBRKAVBMYYSF-UHFFFAOYNA-N |
| Molecular Formula | C18H22ClNO3 |
N,N-Dimethyl-p-toluidine 98.0+%, TCI America™
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CAS: 99-97-8 Molecular Formula: C9H13N Molecular Weight (g/mol): 135.21 MDL Number: MFCD00008316 InChI Key: GYVGXEWAOAAJEU-UHFFFAOYSA-N Synonym: n,n-dimethyl-p-toluidine,dimethyl-p-toluidine,benzenamine, n,n,4-trimethyl,n,n-dimethyl-4-methylaniline,n,n-dimethyl-para-toluidine,4,n,n-trimethylaniline,dimethyl-4-toluidine,p-dimethylamino toluene,n,n-dimethyl-p-tolylamine,n,n,4-trimethylbenzenamine PubChem CID: 7471 IUPAC Name: N,N,4-trimethylaniline SMILES: CN(C)C1=CC=C(C)C=C1
| PubChem CID | 7471 |
|---|---|
| CAS | 99-97-8 |
| Molecular Weight (g/mol) | 135.21 |
| MDL Number | MFCD00008316 |
| SMILES | CN(C)C1=CC=C(C)C=C1 |
| Synonym | n,n-dimethyl-p-toluidine,dimethyl-p-toluidine,benzenamine, n,n,4-trimethyl,n,n-dimethyl-4-methylaniline,n,n-dimethyl-para-toluidine,4,n,n-trimethylaniline,dimethyl-4-toluidine,p-dimethylamino toluene,n,n-dimethyl-p-tolylamine,n,n,4-trimethylbenzenamine |
| IUPAC Name | N,N,4-trimethylaniline |
| InChI Key | GYVGXEWAOAAJEU-UHFFFAOYSA-N |
| Molecular Formula | C9H13N |
1,1-Diphenylethylene (stabilized with HQ) 98.0+%, TCI America™
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CAS: 530-48-3 Molecular Formula: C14H12 Molecular Weight (g/mol): 180.25 MDL Number: MFCD00008583 InChI Key: ZMYIIHDQURVDRB-UHFFFAOYSA-N Synonym: 1,1-diphenylethylene,ethene-1,1-diyldibenzene,1,1-diphenylethene,benzene, 1,1'-ethenylidenebis,1-phenylethenyl benzene,unii-bx0l5b6lll,as-diphenylethylene,.alpha.-phenylstyrene,1-phenylvinyl benzene,bx0l5b6lll PubChem CID: 10740 IUPAC Name: 1-phenylethenylbenzene SMILES: C=C(C1=CC=CC=C1)C2=CC=CC=C2
| PubChem CID | 10740 |
|---|---|
| CAS | 530-48-3 |
| Molecular Weight (g/mol) | 180.25 |
| MDL Number | MFCD00008583 |
| SMILES | C=C(C1=CC=CC=C1)C2=CC=CC=C2 |
| Synonym | 1,1-diphenylethylene,ethene-1,1-diyldibenzene,1,1-diphenylethene,benzene, 1,1'-ethenylidenebis,1-phenylethenyl benzene,unii-bx0l5b6lll,as-diphenylethylene,.alpha.-phenylstyrene,1-phenylvinyl benzene,bx0l5b6lll |
| IUPAC Name | 1-phenylethenylbenzene |
| InChI Key | ZMYIIHDQURVDRB-UHFFFAOYSA-N |
| Molecular Formula | C14H12 |
3-Methoxy-4-methylbenzoic Acid 98.0+%, TCI America™
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CAS: 7151-68-0 Molecular Formula: C9H10O3 Molecular Weight (g/mol): 166.18 MDL Number: MFCD00002566 InChI Key: CEAVPXDEPGAVDA-UHFFFAOYSA-N Synonym: 4-methyl-m-anisic acid,3-methoxy-p-toluic acid,benzoic acid, 3-methoxy-4-methyl,3-methoxy-4-methyl-benzoic acid,3-methoxy-4-methyl benzoic acid,3-methoxy-p-toluic acid; 4-methyl-m-anisic acid,3-methoxy-4-methylbenzoicacid,pubchem2672,5-carboxy-2-methylanisole,acmc-209oj0 PubChem CID: 81579 IUPAC Name: 3-methoxy-4-methylbenzoic acid SMILES: COC1=CC(=CC=C1C)C(O)=O
| PubChem CID | 81579 |
|---|---|
| CAS | 7151-68-0 |
| Molecular Weight (g/mol) | 166.18 |
| MDL Number | MFCD00002566 |
| SMILES | COC1=CC(=CC=C1C)C(O)=O |
| Synonym | 4-methyl-m-anisic acid,3-methoxy-p-toluic acid,benzoic acid, 3-methoxy-4-methyl,3-methoxy-4-methyl-benzoic acid,3-methoxy-4-methyl benzoic acid,3-methoxy-p-toluic acid; 4-methyl-m-anisic acid,3-methoxy-4-methylbenzoicacid,pubchem2672,5-carboxy-2-methylanisole,acmc-209oj0 |
| IUPAC Name | 3-methoxy-4-methylbenzoic acid |
| InChI Key | CEAVPXDEPGAVDA-UHFFFAOYSA-N |
| Molecular Formula | C9H10O3 |
[(R)-2,2'-Bis(diphenylphosphino)-1,1'-binaphthyl]ruthenium(II) Dichloride, TCI America™
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CAS: 132071-87-5 Molecular Formula: C44H32Cl2P2Ru Molecular Weight (g/mol): 794.66 MDL Number: MFCD01073794 InChI Key: YEKBVMDAGDTOQB-UHFFFAOYSA-L Synonym: Dichloro[(R)-2,2′C-bis(diphenylphosphino)-1,1′C-binaphthyl]ruthenium(II) PubChem CID: 11136527 IUPAC Name: [2'-(diphenylphosphanyl)-[1,1'-binaphthalen]-2-yl]diphenylphosphane; dichlororuthenium SMILES: Cl[Ru]Cl.C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=C2C=CC=CC2=C1C1=C2C=CC=CC2=CC=C1P(C1=CC=CC=C1)C1=CC=CC=C1
| PubChem CID | 11136527 |
|---|---|
| CAS | 132071-87-5 |
| Molecular Weight (g/mol) | 794.66 |
| MDL Number | MFCD01073794 |
| SMILES | Cl[Ru]Cl.C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=C2C=CC=CC2=C1C1=C2C=CC=CC2=CC=C1P(C1=CC=CC=C1)C1=CC=CC=C1 |
| Synonym | Dichloro[(R)-2,2′C-bis(diphenylphosphino)-1,1′C-binaphthyl]ruthenium(II) |
| IUPAC Name | [2'-(diphenylphosphanyl)-[1,1'-binaphthalen]-2-yl]diphenylphosphane; dichlororuthenium |
| InChI Key | YEKBVMDAGDTOQB-UHFFFAOYSA-L |
| Molecular Formula | C44H32Cl2P2Ru |
4-Bromo-2-fluorotoluene 97.0+%, TCI America™
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CAS: 51436-99-8 Molecular Formula: C7H6BrF Molecular Weight (g/mol): 189.027 MDL Number: MFCD00013551 InChI Key: YZFVUQSAJMLFOZ-UHFFFAOYSA-N Synonym: 4-bromo-2-fluorotoluene,2-fluoro-4-bromotoluene,benzene, 4-bromo-2-fluoro-1-methyl,toluene,2-fluoro-4-bromo,4-bromo-2-fluoro-1-methyl-benzene,pubchem1601,acmc-1an2v,2-fluoro-4-bromo toluene,4-bromo-2-fluoro-toluene PubChem CID: 171040 IUPAC Name: 4-bromo-2-fluoro-1-methylbenzene SMILES: CC1=C(C=C(C=C1)Br)F
| PubChem CID | 171040 |
|---|---|
| CAS | 51436-99-8 |
| Molecular Weight (g/mol) | 189.027 |
| MDL Number | MFCD00013551 |
| SMILES | CC1=C(C=C(C=C1)Br)F |
| Synonym | 4-bromo-2-fluorotoluene,2-fluoro-4-bromotoluene,benzene, 4-bromo-2-fluoro-1-methyl,toluene,2-fluoro-4-bromo,4-bromo-2-fluoro-1-methyl-benzene,pubchem1601,acmc-1an2v,2-fluoro-4-bromo toluene,4-bromo-2-fluoro-toluene |
| IUPAC Name | 4-bromo-2-fluoro-1-methylbenzene |
| InChI Key | YZFVUQSAJMLFOZ-UHFFFAOYSA-N |
| Molecular Formula | C7H6BrF |