Benzenoids
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2-Bromophenylhydrazine Hydrochloride Hydrate 98.0+%, TCI America™
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CAS: 50709-33-6 Molecular Formula: C6H8BrClN2 Molecular Weight (g/mol): 223.498 MDL Number: MFCD00012926 InChI Key: PHCYUJRYSFMJMG-UHFFFAOYSA-N Synonym: 2-bromophenylhydrazine hydrochloride,2-bromophenyl hydrazine hydrochloride,2-bromophenylhydrazine hcl,hydrazine, 2-bromophenyl-, monohydrochloride,1-2-bromophenyl hydrazine hydrochloride,1-bromo-2-hydrazino benzene hydrochloride,pubchem4463,acmc-1b1zz,ksc270g5h,2-bromophenylhydrazine, chloride PubChem CID: 2723912 IUPAC Name: (2-bromophenyl)hydrazine;hydrochloride SMILES: C1=CC=C(C(=C1)NN)Br.Cl
| PubChem CID | 2723912 |
|---|---|
| CAS | 50709-33-6 |
| Molecular Weight (g/mol) | 223.498 |
| MDL Number | MFCD00012926 |
| SMILES | C1=CC=C(C(=C1)NN)Br.Cl |
| Synonym | 2-bromophenylhydrazine hydrochloride,2-bromophenyl hydrazine hydrochloride,2-bromophenylhydrazine hcl,hydrazine, 2-bromophenyl-, monohydrochloride,1-2-bromophenyl hydrazine hydrochloride,1-bromo-2-hydrazino benzene hydrochloride,pubchem4463,acmc-1b1zz,ksc270g5h,2-bromophenylhydrazine, chloride |
| IUPAC Name | (2-bromophenyl)hydrazine;hydrochloride |
| InChI Key | PHCYUJRYSFMJMG-UHFFFAOYSA-N |
| Molecular Formula | C6H8BrClN2 |
4,4,5,5-Tetramethyl-2-(triphenylen-2-yl)-1,3,2-dioxaborolane 97.0+%, TCI America™
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CAS: 890042-13-4 Molecular Formula: C24H23BO2 Molecular Weight (g/mol): 354.26 MDL Number: MFCD26401844 InChI Key: VXLBBSLCTFTKOE-UHFFFAOYSA-N Synonym: 2-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)triphenylene, Triphenylen-2-ylboronic Acid Pinacol Ester PubChem CID: 58769449 IUPAC Name: 4,4,5,5-tetramethyl-2-(triphenylen-2-yl)-1,3,2-dioxaborolane SMILES: CC1(C)OB(OC1(C)C)C1=CC=C2C3=CC=CC=C3C3=CC=CC=C3C2=C1
| PubChem CID | 58769449 |
|---|---|
| CAS | 890042-13-4 |
| Molecular Weight (g/mol) | 354.26 |
| MDL Number | MFCD26401844 |
| SMILES | CC1(C)OB(OC1(C)C)C1=CC=C2C3=CC=CC=C3C3=CC=CC=C3C2=C1 |
| Synonym | 2-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)triphenylene, Triphenylen-2-ylboronic Acid Pinacol Ester |
| IUPAC Name | 4,4,5,5-tetramethyl-2-(triphenylen-2-yl)-1,3,2-dioxaborolane |
| InChI Key | VXLBBSLCTFTKOE-UHFFFAOYSA-N |
| Molecular Formula | C24H23BO2 |
o-Acetanisidide 98.0+%, TCI America™
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Bis(tri-o-tolylphosphine)palladium(II) Dichloride 90.0+%, TCI America™
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CAS: 40691-33-6 Molecular Formula: C42H42Cl2P2Pd Molecular Weight (g/mol): 786.06 MDL Number: MFCD00274659 InChI Key: GMLMZLGOMMIIMA-UHFFFAOYSA-L Synonym: palladium,dichlorobis tris 2-methylphenyl phosphine PubChem CID: 90656943 IUPAC Name: dichloropalladiumbis(ylium); bis(tris(2-methylphenyl)phosphane) SMILES: Cl[Pd++]Cl.CC1=CC=CC=C1P(C1=C(C)C=CC=C1)C1=C(C)C=CC=C1.CC1=CC=CC=C1P(C1=C(C)C=CC=C1)C1=C(C)C=CC=C1
| PubChem CID | 90656943 |
|---|---|
| CAS | 40691-33-6 |
| Molecular Weight (g/mol) | 786.06 |
| MDL Number | MFCD00274659 |
| SMILES | Cl[Pd++]Cl.CC1=CC=CC=C1P(C1=C(C)C=CC=C1)C1=C(C)C=CC=C1.CC1=CC=CC=C1P(C1=C(C)C=CC=C1)C1=C(C)C=CC=C1 |
| Synonym | palladium,dichlorobis tris 2-methylphenyl phosphine |
| IUPAC Name | dichloropalladiumbis(ylium); bis(tris(2-methylphenyl)phosphane) |
| InChI Key | GMLMZLGOMMIIMA-UHFFFAOYSA-L |
| Molecular Formula | C42H42Cl2P2Pd |
m-Tolyldiethanolamine 98.0+%, TCI America™
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CAS: 91-99-6 Molecular Formula: C11H17NO2 Molecular Weight (g/mol): 195.26 MDL Number: MFCD00020578 InChI Key: VMNDRLYLEVCGAG-UHFFFAOYSA-N PubChem CID: 7073 IUPAC Name: 2-[(2-hydroxyethyl)(3-methylphenyl)amino]ethan-1-ol SMILES: CC1=CC=CC(=C1)N(CCO)CCO
| PubChem CID | 7073 |
|---|---|
| CAS | 91-99-6 |
| Molecular Weight (g/mol) | 195.26 |
| MDL Number | MFCD00020578 |
| SMILES | CC1=CC=CC(=C1)N(CCO)CCO |
| IUPAC Name | 2-[(2-hydroxyethyl)(3-methylphenyl)amino]ethan-1-ol |
| InChI Key | VMNDRLYLEVCGAG-UHFFFAOYSA-N |
| Molecular Formula | C11H17NO2 |
Bis(6-hydroxy-2-naphthyl) Disulfide 95.0+%, TCI America™
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CAS: 6088-51-3 Molecular Formula: C20H14O2S2 Molecular Weight (g/mol): 350.45 MDL Number: MFCD00004083 InChI Key: AHXGXXJEEHFHDK-UHFFFAOYSA-N Synonym: DDD, 6,6′C-Dihydroxy-2,2′C-dinaphthyl Disulfide, 6-Hydroxy-2-naphthyl Disulfide PubChem CID: 22463 IUPAC Name: 6-[(6-hydroxynaphthalen-2-yl)disulfanyl]naphthalen-2-ol SMILES: C1=CC2=C(C=CC(=C2)SSC3=CC4=C(C=C3)C=C(C=C4)O)C=C1O
| PubChem CID | 22463 |
|---|---|
| CAS | 6088-51-3 |
| Molecular Weight (g/mol) | 350.45 |
| MDL Number | MFCD00004083 |
| SMILES | C1=CC2=C(C=CC(=C2)SSC3=CC4=C(C=C3)C=C(C=C4)O)C=C1O |
| Synonym | DDD, 6,6′C-Dihydroxy-2,2′C-dinaphthyl Disulfide, 6-Hydroxy-2-naphthyl Disulfide |
| IUPAC Name | 6-[(6-hydroxynaphthalen-2-yl)disulfanyl]naphthalen-2-ol |
| InChI Key | AHXGXXJEEHFHDK-UHFFFAOYSA-N |
| Molecular Formula | C20H14O2S2 |
Methyl 4-Fluorobenzoate 97.0+%, TCI America™
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CAS: 403-33-8 Molecular Formula: C8H7FO2 Molecular Weight (g/mol): 154.14 MDL Number: MFCD00017959 InChI Key: MSEBQGULDWDIRW-UHFFFAOYSA-N Synonym: methyl p-fluorobenzoate,4-fluorobenzoic acid methyl ester,methyl 4-fluorobenzoic acid,benzoic acid, 4-fluoro-, methyl ester,methyl4-fluorobenzoate,methyl-4-fluorobenzoate,4-fluoro-benzoic acid methyl ester,pubchem3566,acmc-1aef0,asischem p32019 PubChem CID: 67878 IUPAC Name: methyl 4-fluorobenzoate SMILES: COC(=O)C1=CC=C(C=C1)F
| PubChem CID | 67878 |
|---|---|
| CAS | 403-33-8 |
| Molecular Weight (g/mol) | 154.14 |
| MDL Number | MFCD00017959 |
| SMILES | COC(=O)C1=CC=C(C=C1)F |
| Synonym | methyl p-fluorobenzoate,4-fluorobenzoic acid methyl ester,methyl 4-fluorobenzoic acid,benzoic acid, 4-fluoro-, methyl ester,methyl4-fluorobenzoate,methyl-4-fluorobenzoate,4-fluoro-benzoic acid methyl ester,pubchem3566,acmc-1aef0,asischem p32019 |
| IUPAC Name | methyl 4-fluorobenzoate |
| InChI Key | MSEBQGULDWDIRW-UHFFFAOYSA-N |
| Molecular Formula | C8H7FO2 |
1,6-Diaminopyrene 98.0+%, TCI America™
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CAS: 14923-84-3 Molecular Formula: C16H12N2 Molecular Weight (g/mol): 232.29 MDL Number: MFCD00142568 InChI Key: OWJJRQSAIMYXQJ-UHFFFAOYSA-N PubChem CID: 146178 IUPAC Name: pyrene-1,6-diamine SMILES: NC1=CC=C2C=CC3=C(N)C=CC4=CC=C1C2=C34
| PubChem CID | 146178 |
|---|---|
| CAS | 14923-84-3 |
| Molecular Weight (g/mol) | 232.29 |
| MDL Number | MFCD00142568 |
| SMILES | NC1=CC=C2C=CC3=C(N)C=CC4=CC=C1C2=C34 |
| IUPAC Name | pyrene-1,6-diamine |
| InChI Key | OWJJRQSAIMYXQJ-UHFFFAOYSA-N |
| Molecular Formula | C16H12N2 |
Benzyl Butyl Ether 95.0+%, TCI America™
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CAS: 588-67-0 Molecular Formula: C11H16O Molecular Weight (g/mol): 164.25 MDL Number: MFCD00039954 InChI Key: MAYUYFCAPVDYBQ-UHFFFAOYSA-N Synonym: benzyl butyl ether,ether, benzyl butyl,butyl benzyl ether,benzyl n-butyl ether,benzene, butoxymethyl,butoxymethyl benzene,n-butyl benzyl ether,unii-8483x8zo8n,ether, benzyl n-butyl,butoxyphenylmethane PubChem CID: 61134 IUPAC Name: (butoxymethyl)benzene SMILES: CCCCOCC1=CC=CC=C1
| PubChem CID | 61134 |
|---|---|
| CAS | 588-67-0 |
| Molecular Weight (g/mol) | 164.25 |
| MDL Number | MFCD00039954 |
| SMILES | CCCCOCC1=CC=CC=C1 |
| Synonym | benzyl butyl ether,ether, benzyl butyl,butyl benzyl ether,benzyl n-butyl ether,benzene, butoxymethyl,butoxymethyl benzene,n-butyl benzyl ether,unii-8483x8zo8n,ether, benzyl n-butyl,butoxyphenylmethane |
| IUPAC Name | (butoxymethyl)benzene |
| InChI Key | MAYUYFCAPVDYBQ-UHFFFAOYSA-N |
| Molecular Formula | C11H16O |
Bis(4-bromophenylboronic Acid) scyllo-Inositol Complex Dipotassium Tetrahydrate 98.0+%, TCI America™
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CAS: 1537876-29-1 Molecular Formula: C18H14B2Br2K2O6 Molecular Weight (g/mol): 585.929 InChI Key: KFMXNLSRMBTKTI-UHFFFAOYSA-N PubChem CID: 91972154 SMILES: [B-]12(OC3C4C(O1)C5C(C3O[B-](O4)(O5)C6=CC=C(C=C6)Br)O2)C7=CC=C(C=C7)Br.[K+].[K+]
| PubChem CID | 91972154 |
|---|---|
| CAS | 1537876-29-1 |
| Molecular Weight (g/mol) | 585.929 |
| SMILES | [B-]12(OC3C4C(O1)C5C(C3O[B-](O4)(O5)C6=CC=C(C=C6)Br)O2)C7=CC=C(C=C7)Br.[K+].[K+] |
| InChI Key | KFMXNLSRMBTKTI-UHFFFAOYSA-N |
| Molecular Formula | C18H14B2Br2K2O6 |
4-(1H-Pyrazol-1-yl)benzoic Acid 98.0+%, TCI America™
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CAS: 16209-00-0 Molecular Formula: C10H8N2O2 Molecular Weight (g/mol): 188.186 MDL Number: MFCD02682056 InChI Key: XOEKYPIBVOGCDG-UHFFFAOYSA-N Synonym: 4-1h-pyrazol-1-yl benzoic acid,4-1-pyrazolyl benzoic acid,benzoic acid, 4-1h-pyrazol-1-yl,4-pyrazol-1-yl benzoic acid,4-pyrazol-1-yl-benzoic acid,4-pyrazolylbenzoic acid,pubchem19583,acmc-1bo47,benzoic acid, 4-pyrazol-1-yl,4-1h-pyrazole-1-yl benzoic acid PubChem CID: 736527 IUPAC Name: 4-pyrazol-1-ylbenzoic acid SMILES: C1=CN(N=C1)C2=CC=C(C=C2)C(=O)O
| PubChem CID | 736527 |
|---|---|
| CAS | 16209-00-0 |
| Molecular Weight (g/mol) | 188.186 |
| MDL Number | MFCD02682056 |
| SMILES | C1=CN(N=C1)C2=CC=C(C=C2)C(=O)O |
| Synonym | 4-1h-pyrazol-1-yl benzoic acid,4-1-pyrazolyl benzoic acid,benzoic acid, 4-1h-pyrazol-1-yl,4-pyrazol-1-yl benzoic acid,4-pyrazol-1-yl-benzoic acid,4-pyrazolylbenzoic acid,pubchem19583,acmc-1bo47,benzoic acid, 4-pyrazol-1-yl,4-1h-pyrazole-1-yl benzoic acid |
| IUPAC Name | 4-pyrazol-1-ylbenzoic acid |
| InChI Key | XOEKYPIBVOGCDG-UHFFFAOYSA-N |
| Molecular Formula | C10H8N2O2 |
2,3,6-Trifluorophenol 95.0+%, TCI America™
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CAS: 113798-74-6 Molecular Formula: C6H3F3O Molecular Weight (g/mol): 148.08 MDL Number: MFCD00061214 InChI Key: QSFGUSFDWCVXNR-UHFFFAOYSA-N PubChem CID: 517988 IUPAC Name: 2,3,6-trifluorophenol SMILES: OC1=C(F)C=CC(F)=C1F
| PubChem CID | 517988 |
|---|---|
| CAS | 113798-74-6 |
| Molecular Weight (g/mol) | 148.08 |
| MDL Number | MFCD00061214 |
| SMILES | OC1=C(F)C=CC(F)=C1F |
| IUPAC Name | 2,3,6-trifluorophenol |
| InChI Key | QSFGUSFDWCVXNR-UHFFFAOYSA-N |
| Molecular Formula | C6H3F3O |
N,N'-Diacetylsulfanilamide 98.0+%, TCI America™
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CAS: 29591-86-4 Molecular Formula: C10H12N2O4S Molecular Weight (g/mol): 256.276 MDL Number: MFCD00008678 InChI Key: YTJJPFRVBNFIBN-UHFFFAOYSA-N PubChem CID: 101240 IUPAC Name: N-[4-(acetylsulfamoyl)phenyl]acetamide SMILES: CC(=O)NC1=CC=C(C=C1)S(=O)(=O)NC(=O)C
| PubChem CID | 101240 |
|---|---|
| CAS | 29591-86-4 |
| Molecular Weight (g/mol) | 256.276 |
| MDL Number | MFCD00008678 |
| SMILES | CC(=O)NC1=CC=C(C=C1)S(=O)(=O)NC(=O)C |
| IUPAC Name | N-[4-(acetylsulfamoyl)phenyl]acetamide |
| InChI Key | YTJJPFRVBNFIBN-UHFFFAOYSA-N |
| Molecular Formula | C10H12N2O4S |
2-Methoxyphenylacetonitrile 98.0+%, TCI America™
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CAS: 7035-03-2 Molecular Formula: C9H9NO Molecular Weight (g/mol): 147.18 MDL Number: MFCD00001902 InChI Key: DWJKILXTMUGXOU-UHFFFAOYSA-N Synonym: 2-methoxyphenyl acetonitrile,2-methoxyphenylacetonitrile,2-methoxybenzyl cyanide,2-2-methoxyphenyl acetonitrile,benzeneacetonitrile, 2-methoxy,o-methoxyphenylacetonitrile,o-methoxybenzyl cyanide,o-methoxyphenyl acetonitrile,2-2-methoxyphenyl ethanenitrile,2-methoxybenzylcyanid PubChem CID: 81496 IUPAC Name: 2-(2-methoxyphenyl)acetonitrile SMILES: COC1=CC=CC=C1CC#N
| PubChem CID | 81496 |
|---|---|
| CAS | 7035-03-2 |
| Molecular Weight (g/mol) | 147.18 |
| MDL Number | MFCD00001902 |
| SMILES | COC1=CC=CC=C1CC#N |
| Synonym | 2-methoxyphenyl acetonitrile,2-methoxyphenylacetonitrile,2-methoxybenzyl cyanide,2-2-methoxyphenyl acetonitrile,benzeneacetonitrile, 2-methoxy,o-methoxyphenylacetonitrile,o-methoxybenzyl cyanide,o-methoxyphenyl acetonitrile,2-2-methoxyphenyl ethanenitrile,2-methoxybenzylcyanid |
| IUPAC Name | 2-(2-methoxyphenyl)acetonitrile |
| InChI Key | DWJKILXTMUGXOU-UHFFFAOYSA-N |
| Molecular Formula | C9H9NO |
trans,trans-1,5-Bis(4-fluorophenyl)-1,4-pentadien-3-one 98.0+%, TCI America™
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CAS: 53369-00-9 Molecular Formula: C17H12F2O Molecular Weight (g/mol): 270.279 MDL Number: MFCD00298485 InChI Key: BNHFGYIPXPENKA-YDWXAUTNSA-N Synonym: trans,trans-Bis(4-fluorobenzal)acetone, trans,trans-Bis(4-fluorobenzylidene)acetone, trans,trans-Bis(4-fluorostyryl) Ketone PubChem CID: 1268251 IUPAC Name: (1E,4E)-1,5-bis(4-fluorophenyl)penta-1,4-dien-3-one SMILES: C1=CC(=CC=C1C=CC(=O)C=CC2=CC=C(C=C2)F)F
| PubChem CID | 1268251 |
|---|---|
| CAS | 53369-00-9 |
| Molecular Weight (g/mol) | 270.279 |
| MDL Number | MFCD00298485 |
| SMILES | C1=CC(=CC=C1C=CC(=O)C=CC2=CC=C(C=C2)F)F |
| Synonym | trans,trans-Bis(4-fluorobenzal)acetone, trans,trans-Bis(4-fluorobenzylidene)acetone, trans,trans-Bis(4-fluorostyryl) Ketone |
| IUPAC Name | (1E,4E)-1,5-bis(4-fluorophenyl)penta-1,4-dien-3-one |
| InChI Key | BNHFGYIPXPENKA-YDWXAUTNSA-N |
| Molecular Formula | C17H12F2O |