Benzenoids
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3-Amino-2-naphthol 98.0+%, TCI America™
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CAS: 5417-63-0 Molecular Formula: C10H9NO Molecular Weight (g/mol): 159.188 MDL Number: MFCD00004113 InChI Key: ZHVPTERSBUMMHK-UHFFFAOYSA-N Synonym: 3-amino-2-naphthol,2-naphthalenol, 3-amino,2-amino-3-naphthol,3-amino-2-hydroxynaphthalene,2-naphthol, 3-amino,2-amino-3-hydroxynaphthalene,unii-29bke27d17,3-amino-naphthalen-2-ol,acmc-209ldx,3-amino-2-naphthalenol PubChem CID: 79449 IUPAC Name: 3-aminonaphthalen-2-ol SMILES: C1=CC=C2C=C(C(=CC2=C1)N)O
| PubChem CID | 79449 |
|---|---|
| CAS | 5417-63-0 |
| Molecular Weight (g/mol) | 159.188 |
| MDL Number | MFCD00004113 |
| SMILES | C1=CC=C2C=C(C(=CC2=C1)N)O |
| Synonym | 3-amino-2-naphthol,2-naphthalenol, 3-amino,2-amino-3-naphthol,3-amino-2-hydroxynaphthalene,2-naphthol, 3-amino,2-amino-3-hydroxynaphthalene,unii-29bke27d17,3-amino-naphthalen-2-ol,acmc-209ldx,3-amino-2-naphthalenol |
| IUPAC Name | 3-aminonaphthalen-2-ol |
| InChI Key | ZHVPTERSBUMMHK-UHFFFAOYSA-N |
| Molecular Formula | C10H9NO |
4-Fluorophenyl Isocyanate 98.0+%, TCI America™
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CAS: 1195-45-5 Molecular Formula: C7H4FNO Molecular Weight (g/mol): 137.113 MDL Number: MFCD00002023 InChI Key: DSVGFKBFFICWLZ-UHFFFAOYSA-N PubChem CID: 70955 IUPAC Name: 1-fluoro-4-isocyanatobenzene SMILES: C1=CC(=CC=C1N=C=O)F
| PubChem CID | 70955 |
|---|---|
| CAS | 1195-45-5 |
| Molecular Weight (g/mol) | 137.113 |
| MDL Number | MFCD00002023 |
| SMILES | C1=CC(=CC=C1N=C=O)F |
| IUPAC Name | 1-fluoro-4-isocyanatobenzene |
| InChI Key | DSVGFKBFFICWLZ-UHFFFAOYSA-N |
| Molecular Formula | C7H4FNO |
Amyl Benzoate 98.0+%, TCI America™
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CAS: 2049-96-9 Molecular Formula: C12H16O2 Molecular Weight (g/mol): 192.258 MDL Number: MFCD00048843 InChI Key: QKNZNUNCDJZTCH-UHFFFAOYSA-N Synonym: amyl benzoate,n-pentyl benzoate,benzoic acid, pentyl ester,n-amyl benzoate,unii-cle7k4b29s,cle7k4b29s,amylbenzoat,amylbenzoate,n amyl benxoate,benzoic acid pentyl PubChem CID: 16296 IUPAC Name: pentyl benzoate SMILES: CCCCCOC(=O)C1=CC=CC=C1
| PubChem CID | 16296 |
|---|---|
| CAS | 2049-96-9 |
| Molecular Weight (g/mol) | 192.258 |
| MDL Number | MFCD00048843 |
| SMILES | CCCCCOC(=O)C1=CC=CC=C1 |
| Synonym | amyl benzoate,n-pentyl benzoate,benzoic acid, pentyl ester,n-amyl benzoate,unii-cle7k4b29s,cle7k4b29s,amylbenzoat,amylbenzoate,n amyl benxoate,benzoic acid pentyl |
| IUPAC Name | pentyl benzoate |
| InChI Key | QKNZNUNCDJZTCH-UHFFFAOYSA-N |
| Molecular Formula | C12H16O2 |
[1,3-Bis(2,6-diisopropylphenyl)imidazol-2-ylidene]triphenylphosphine Nickel(II) Dichloride 98.0+%, TCI America™
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CAS: 903592-98-3 Molecular Formula: C45H51Cl2N2NiP Molecular Weight (g/mol): 780.484 InChI Key: IGLKEXXECLLIAD-UHFFFAOYSA-L PubChem CID: 56923621 IUPAC Name: [1,3-bis[2,6-di(propan-2-yl)phenyl]imidazol-2-ylidene]-triphenyl-$l^{5}-phosphane;dichloronickel SMILES: CC(C)C1=C(C(=CC=C1)C(C)C)N2C=CN(C2=P(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5)C6=C(C=CC=C6C(C)C)C(C)C.Cl[Ni]Cl
| PubChem CID | 56923621 |
|---|---|
| CAS | 903592-98-3 |
| Molecular Weight (g/mol) | 780.484 |
| SMILES | CC(C)C1=C(C(=CC=C1)C(C)C)N2C=CN(C2=P(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5)C6=C(C=CC=C6C(C)C)C(C)C.Cl[Ni]Cl |
| IUPAC Name | [1,3-bis[2,6-di(propan-2-yl)phenyl]imidazol-2-ylidene]-triphenyl-$l^{5}-phosphane;dichloronickel |
| InChI Key | IGLKEXXECLLIAD-UHFFFAOYSA-L |
| Molecular Formula | C45H51Cl2N2NiP |
2,6-Dimethoxyaniline 98.0+%, TCI America™
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CAS: 2734-70-5 Molecular Formula: C8H11NO2 Molecular Weight (g/mol): 153.181 MDL Number: MFCD00053934 InChI Key: HQBJSEKQNRSDAZ-UHFFFAOYSA-N Synonym: benzenamine, 2,6-dimethoxy,2,6-dimethoxyphenylamine,2,6-dimethoxybenzenamine,2,6-dimethoxy-phenylamine,buttpark 33\04-69,2 6-dimethoxyaniline,pubchem4419,2,6-dimethoxy aniline,acmc-1cnwd,ksc497k1h PubChem CID: 95940 IUPAC Name: 2,6-dimethoxyaniline SMILES: COC1=C(C(=CC=C1)OC)N
| PubChem CID | 95940 |
|---|---|
| CAS | 2734-70-5 |
| Molecular Weight (g/mol) | 153.181 |
| MDL Number | MFCD00053934 |
| SMILES | COC1=C(C(=CC=C1)OC)N |
| Synonym | benzenamine, 2,6-dimethoxy,2,6-dimethoxyphenylamine,2,6-dimethoxybenzenamine,2,6-dimethoxy-phenylamine,buttpark 33\04-69,2 6-dimethoxyaniline,pubchem4419,2,6-dimethoxy aniline,acmc-1cnwd,ksc497k1h |
| IUPAC Name | 2,6-dimethoxyaniline |
| InChI Key | HQBJSEKQNRSDAZ-UHFFFAOYSA-N |
| Molecular Formula | C8H11NO2 |
3-Amino-4-bromobenzoic Acid 98.0+%, TCI America™
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CAS: 2840-29-1 Molecular Formula: C7H6BrNO2 Molecular Weight (g/mol): 216.034 MDL Number: MFCD00579106 InChI Key: TZFJADFQEBASQU-UHFFFAOYSA-N Synonym: 3-amino-4-bromo-benzoic acid,benzoic acid, 3-amino-4-bromo,3-amino-4-bromobenzoicacid,acmc-1cpid,4-brom-3-aminobenzoesaure,ksc494k6h,3-amino-4-bromobenzoic acid,3-amino-4-bromo benzoic acid PubChem CID: 3418752 IUPAC Name: 3-amino-4-bromobenzoic acid SMILES: C1=CC(=C(C=C1C(=O)O)N)Br
| PubChem CID | 3418752 |
|---|---|
| CAS | 2840-29-1 |
| Molecular Weight (g/mol) | 216.034 |
| MDL Number | MFCD00579106 |
| SMILES | C1=CC(=C(C=C1C(=O)O)N)Br |
| Synonym | 3-amino-4-bromo-benzoic acid,benzoic acid, 3-amino-4-bromo,3-amino-4-bromobenzoicacid,acmc-1cpid,4-brom-3-aminobenzoesaure,ksc494k6h,3-amino-4-bromobenzoic acid,3-amino-4-bromo benzoic acid |
| IUPAC Name | 3-amino-4-bromobenzoic acid |
| InChI Key | TZFJADFQEBASQU-UHFFFAOYSA-N |
| Molecular Formula | C7H6BrNO2 |
2-Bromo-4-nitroaniline 98.0+%, TCI America™
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CAS: 13296-94-1 Molecular Formula: C6H5BrN2O2 Molecular Weight (g/mol): 217.022 MDL Number: MFCD00025152 InChI Key: CGPPWNTVTNCHDO-UHFFFAOYSA-N PubChem CID: 25840 IUPAC Name: 2-bromo-4-nitroaniline SMILES: C1=CC(=C(C=C1[N+](=O)[O-])Br)N
| PubChem CID | 25840 |
|---|---|
| CAS | 13296-94-1 |
| Molecular Weight (g/mol) | 217.022 |
| MDL Number | MFCD00025152 |
| SMILES | C1=CC(=C(C=C1[N+](=O)[O-])Br)N |
| IUPAC Name | 2-bromo-4-nitroaniline |
| InChI Key | CGPPWNTVTNCHDO-UHFFFAOYSA-N |
| Molecular Formula | C6H5BrN2O2 |
4,4'-Bis(alpha,alpha-dimethylbenzyl)diphenylamine 98.0+%, TCI America™
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CAS: 10081-67-1 Molecular Formula: C30H31N Molecular Weight (g/mol): 405.585 MDL Number: MFCD00337918 InChI Key: UJAWGGOCYUPCPS-UHFFFAOYSA-N PubChem CID: 82343 IUPAC Name: 4-(2-phenylpropan-2-yl)-N-[4-(2-phenylpropan-2-yl)phenyl]aniline SMILES: CC(C)(C1=CC=CC=C1)C2=CC=C(C=C2)NC3=CC=C(C=C3)C(C)(C)C4=CC=CC=C4
| PubChem CID | 82343 |
|---|---|
| CAS | 10081-67-1 |
| Molecular Weight (g/mol) | 405.585 |
| MDL Number | MFCD00337918 |
| SMILES | CC(C)(C1=CC=CC=C1)C2=CC=C(C=C2)NC3=CC=C(C=C3)C(C)(C)C4=CC=CC=C4 |
| IUPAC Name | 4-(2-phenylpropan-2-yl)-N-[4-(2-phenylpropan-2-yl)phenyl]aniline |
| InChI Key | UJAWGGOCYUPCPS-UHFFFAOYSA-N |
| Molecular Formula | C30H31N |
2,3-Dichlorophenylhydrazine Hydrochloride 97.0+%, TCI America™
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CAS: 21938-47-6 Molecular Formula: C6H6Cl2N2 Molecular Weight (g/mol): 177.03 MDL Number: MFCD00052265 InChI Key: HPIALSXRVQRGMK-UHFFFAOYSA-N Synonym: 2,3-dichlorophenylhydrazine hydrochloride,2,3-dichlorophenyl hydrazine hydrochloride,hydrazine, 2,3-dichlorophenyl-, monohydrochloride,1-2,3-dichlorophenyl hydrazine hydrochloride,pubchem7561,acmc-209fpn,ksc494k0t,2,3-dichlorophenylhydrazine, chloride,2,3-dichlorophenylhydrazine hcl PubChem CID: 12276572 IUPAC Name: (2,3-dichlorophenyl)hydrazine SMILES: NNC1=CC=CC(Cl)=C1Cl
| PubChem CID | 12276572 |
|---|---|
| CAS | 21938-47-6 |
| Molecular Weight (g/mol) | 177.03 |
| MDL Number | MFCD00052265 |
| SMILES | NNC1=CC=CC(Cl)=C1Cl |
| Synonym | 2,3-dichlorophenylhydrazine hydrochloride,2,3-dichlorophenyl hydrazine hydrochloride,hydrazine, 2,3-dichlorophenyl-, monohydrochloride,1-2,3-dichlorophenyl hydrazine hydrochloride,pubchem7561,acmc-209fpn,ksc494k0t,2,3-dichlorophenylhydrazine, chloride,2,3-dichlorophenylhydrazine hcl |
| IUPAC Name | (2,3-dichlorophenyl)hydrazine |
| InChI Key | HPIALSXRVQRGMK-UHFFFAOYSA-N |
| Molecular Formula | C6H6Cl2N2 |
4-Bromo-3-nitroaniline 98.0+%, TCI America™
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CAS: 53324-38-2 Molecular Formula: C6H5BrN2O2 Molecular Weight (g/mol): 217.02 MDL Number: MFCD01320678 InChI Key: PITHQPMZWKZGRZ-UHFFFAOYSA-N PubChem CID: 612299 IUPAC Name: 4-bromo-3-nitroaniline SMILES: NC1=CC=C(Br)C(=C1)[N+]([O-])=O
| PubChem CID | 612299 |
|---|---|
| CAS | 53324-38-2 |
| Molecular Weight (g/mol) | 217.02 |
| MDL Number | MFCD01320678 |
| SMILES | NC1=CC=C(Br)C(=C1)[N+]([O-])=O |
| IUPAC Name | 4-bromo-3-nitroaniline |
| InChI Key | PITHQPMZWKZGRZ-UHFFFAOYSA-N |
| Molecular Formula | C6H5BrN2O2 |
4-Hydroxy-3,5-dimethoxyphenylacetic Acid 98.0+%, TCI America™
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CAS: 4385-56-2 Molecular Formula: C10H12O5 Molecular Weight (g/mol): 212.201 MDL Number: MFCD00016834 InChI Key: BQBQKSSTFGCRQL-UHFFFAOYSA-N PubChem CID: 78093 IUPAC Name: 2-(4-hydroxy-3,5-dimethoxyphenyl)acetic acid SMILES: COC1=CC(=CC(=C1O)OC)CC(=O)O
| PubChem CID | 78093 |
|---|---|
| CAS | 4385-56-2 |
| Molecular Weight (g/mol) | 212.201 |
| MDL Number | MFCD00016834 |
| SMILES | COC1=CC(=CC(=C1O)OC)CC(=O)O |
| IUPAC Name | 2-(4-hydroxy-3,5-dimethoxyphenyl)acetic acid |
| InChI Key | BQBQKSSTFGCRQL-UHFFFAOYSA-N |
| Molecular Formula | C10H12O5 |
2-(2-Biphenylyl)amino-9,9-dimethylfluorene 98.0+%, TCI America™
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CAS: 1198395-24-2 Molecular Formula: C27H23N Molecular Weight (g/mol): 361.49 MDL Number: MFCD19440968 InChI Key: OBARUOOPPWHZRQ-UHFFFAOYSA-N Synonym: N-([1,1′-Biphenyl]-2-yl)-9,9-dimethyl-9H-fluoren-2-amine PubChem CID: 66803057 IUPAC Name: N-{[1,1'-biphenyl]-2-yl}-9,9-dimethyl-9H-fluoren-2-amine SMILES: CC1(C)C2=CC=CC=C2C2=C1C=C(NC1=CC=CC=C1C1=CC=CC=C1)C=C2
| PubChem CID | 66803057 |
|---|---|
| CAS | 1198395-24-2 |
| Molecular Weight (g/mol) | 361.49 |
| MDL Number | MFCD19440968 |
| SMILES | CC1(C)C2=CC=CC=C2C2=C1C=C(NC1=CC=CC=C1C1=CC=CC=C1)C=C2 |
| Synonym | N-([1,1′-Biphenyl]-2-yl)-9,9-dimethyl-9H-fluoren-2-amine |
| IUPAC Name | N-{[1,1'-biphenyl]-2-yl}-9,9-dimethyl-9H-fluoren-2-amine |
| InChI Key | OBARUOOPPWHZRQ-UHFFFAOYSA-N |
| Molecular Formula | C27H23N |
4-Cyclohexylbenzoic Acid 98.0+%, TCI America™
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CAS: 20029-52-1 Molecular Formula: C13H16O2 Molecular Weight (g/mol): 204.269 MDL Number: MFCD00039459 InChI Key: QCIWHVKGVVQHIY-UHFFFAOYSA-N Synonym: 4-cyclohexyl-benzoic acid,benzoic acid, 4-cyclohexyl,4cyclohexylbenzoic acid,4-cyclohexylbenzoicacid,p-cyclohexylbenzoic acid,acmc-1cmbu,cyclohexybenzoicacid,4-carboxyphenyl cyclohexane PubChem CID: 88337 IUPAC Name: 4-cyclohexylbenzoic acid SMILES: C1CCC(CC1)C2=CC=C(C=C2)C(=O)O
| PubChem CID | 88337 |
|---|---|
| CAS | 20029-52-1 |
| Molecular Weight (g/mol) | 204.269 |
| MDL Number | MFCD00039459 |
| SMILES | C1CCC(CC1)C2=CC=C(C=C2)C(=O)O |
| Synonym | 4-cyclohexyl-benzoic acid,benzoic acid, 4-cyclohexyl,4cyclohexylbenzoic acid,4-cyclohexylbenzoicacid,p-cyclohexylbenzoic acid,acmc-1cmbu,cyclohexybenzoicacid,4-carboxyphenyl cyclohexane |
| IUPAC Name | 4-cyclohexylbenzoic acid |
| InChI Key | QCIWHVKGVVQHIY-UHFFFAOYSA-N |
| Molecular Formula | C13H16O2 |
4,4'-Dihydroxy-3,3',5,5'-tetraisopropylbiphenyl 97.0+%, TCI America™
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CAS: 2416-95-7 Molecular Formula: C24H34O2 Molecular Weight (g/mol): 354.53 MDL Number: MFCD20257818 InChI Key: QAISRHCMPQROAX-UHFFFAOYSA-N Synonym: 3,3′,5,5′-Tetraisopropyl-[1,1′-biphenyl]-4,4′-diol PubChem CID: 11602828 IUPAC Name: 3,3',5,5'-tetrakis(propan-2-yl)-[1,1'-biphenyl]-4,4'-diol SMILES: CC(C)C1=CC(=CC(C(C)C)=C1O)C1=CC(C(C)C)=C(O)C(=C1)C(C)C
| PubChem CID | 11602828 |
|---|---|
| CAS | 2416-95-7 |
| Molecular Weight (g/mol) | 354.53 |
| MDL Number | MFCD20257818 |
| SMILES | CC(C)C1=CC(=CC(C(C)C)=C1O)C1=CC(C(C)C)=C(O)C(=C1)C(C)C |
| Synonym | 3,3′,5,5′-Tetraisopropyl-[1,1′-biphenyl]-4,4′-diol |
| IUPAC Name | 3,3',5,5'-tetrakis(propan-2-yl)-[1,1'-biphenyl]-4,4'-diol |
| InChI Key | QAISRHCMPQROAX-UHFFFAOYSA-N |
| Molecular Formula | C24H34O2 |
Methyl Caffeate 98.0+%, TCI America™
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CAS: 3843-74-1 Molecular Formula: C10H10O4 Molecular Weight (g/mol): 194.186 MDL Number: MFCD00210468 InChI Key: OCNYGKNIVPVPPX-HWKANZROSA-N Synonym: methyl caffeate,methyl 3-3,4-dihydroxyphenyl acrylate,caffeic acid methyl ester,e-methyl 3-3,4-dihydroxyphenyl acrylate,methylcaffeate,methyl 3,4-dihydroxycinnamate,caffeic acid, methyl ester,unii-n79173b9hf,methyl 2e-3-3,4-dihydroxyphenyl prop-2-enoate,chembl17001 PubChem CID: 689075 ChEBI: CHEBI:6856 IUPAC Name: methyl (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate SMILES: COC(=O)C=CC1=CC(=C(C=C1)O)O
| PubChem CID | 689075 |
|---|---|
| CAS | 3843-74-1 |
| Molecular Weight (g/mol) | 194.186 |
| ChEBI | CHEBI:6856 |
| MDL Number | MFCD00210468 |
| SMILES | COC(=O)C=CC1=CC(=C(C=C1)O)O |
| Synonym | methyl caffeate,methyl 3-3,4-dihydroxyphenyl acrylate,caffeic acid methyl ester,e-methyl 3-3,4-dihydroxyphenyl acrylate,methylcaffeate,methyl 3,4-dihydroxycinnamate,caffeic acid, methyl ester,unii-n79173b9hf,methyl 2e-3-3,4-dihydroxyphenyl prop-2-enoate,chembl17001 |
| IUPAC Name | methyl (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate |
| InChI Key | OCNYGKNIVPVPPX-HWKANZROSA-N |
| Molecular Formula | C10H10O4 |