Benzenoids
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9-Fluorenylmethanol 98.0+%, TCI America™
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CAS: 24324-17-2 Molecular Formula: C14H12O Molecular Weight (g/mol): 196.25 MDL Number: MFCD00001139 InChI Key: XXSCONYSQQLHTH-UHFFFAOYSA-N Synonym: 9-fluorenemethanol,9-fluorenylmethanol,9h-fluorene-9-methanol,9-fluorenyl methanol,9h-fluoren-9-yl methanol,fluorene-9-methanol,9-hydroxymethylfluorene,9-fluorenmethanol,hofm,fluoren-9-yl methanol PubChem CID: 90466 IUPAC Name: (9H-fluoren-9-yl)methanol SMILES: OCC1C2=CC=CC=C2C2=CC=CC=C12
| PubChem CID | 90466 |
|---|---|
| CAS | 24324-17-2 |
| Molecular Weight (g/mol) | 196.25 |
| MDL Number | MFCD00001139 |
| SMILES | OCC1C2=CC=CC=C2C2=CC=CC=C12 |
| Synonym | 9-fluorenemethanol,9-fluorenylmethanol,9h-fluorene-9-methanol,9-fluorenyl methanol,9h-fluoren-9-yl methanol,fluorene-9-methanol,9-hydroxymethylfluorene,9-fluorenmethanol,hofm,fluoren-9-yl methanol |
| IUPAC Name | (9H-fluoren-9-yl)methanol |
| InChI Key | XXSCONYSQQLHTH-UHFFFAOYSA-N |
| Molecular Formula | C14H12O |
2-Fluorenecarboxaldehyde 95.0+%, TCI America™
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CAS: 30084-90-3 Molecular Formula: C14H10O Molecular Weight (g/mol): 194.23 MDL Number: MFCD00001123 InChI Key: MNQGEQSXFDKAPY-UHFFFAOYSA-N Synonym: 2-fluorenecarboxaldehyde,fluorene-2-carboxaldehyde,fluorene-2-carbaldehyde,9h-fluorene-2-carboxaldehyde,2-formylfluorene,2-fluorencarbaldehyd,2-fluorenecarboaldehyde,acmc-1cjjq,4-07-00-01656 beilstein handbook reference,# PubChem CID: 34804 IUPAC Name: 9H-fluorene-2-carbaldehyde SMILES: O=CC1=CC=C2C(CC3=CC=CC=C23)=C1
| PubChem CID | 34804 |
|---|---|
| CAS | 30084-90-3 |
| Molecular Weight (g/mol) | 194.23 |
| MDL Number | MFCD00001123 |
| SMILES | O=CC1=CC=C2C(CC3=CC=CC=C23)=C1 |
| Synonym | 2-fluorenecarboxaldehyde,fluorene-2-carboxaldehyde,fluorene-2-carbaldehyde,9h-fluorene-2-carboxaldehyde,2-formylfluorene,2-fluorencarbaldehyd,2-fluorenecarboaldehyde,acmc-1cjjq,4-07-00-01656 beilstein handbook reference,# |
| IUPAC Name | 9H-fluorene-2-carbaldehyde |
| InChI Key | MNQGEQSXFDKAPY-UHFFFAOYSA-N |
| Molecular Formula | C14H10O |
3-Fluorobenzaldehyde 97.0+%, TCI America™
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CAS: 456-48-4 Molecular Formula: C7H5FO Molecular Weight (g/mol): 124.114 MDL Number: MFCD00003348 InChI Key: PIKNVEVCWAAOMJ-UHFFFAOYSA-N Synonym: m-fluorobenzaldehyde,benzaldehyde, 3-fluoro,3'-fluoro-benzaldehyde,3-fluoro-benzaldehyde,meta-fluorobenzaldehyde,benzaldehyde, m-fluoro,3-fc6h4cho,3-fluorobenzaldehyde,3-fluoro benzaldehyde,pubchem3477 PubChem CID: 68009 IUPAC Name: 3-fluorobenzaldehyde SMILES: C1=CC(=CC(=C1)F)C=O
| PubChem CID | 68009 |
|---|---|
| CAS | 456-48-4 |
| Molecular Weight (g/mol) | 124.114 |
| MDL Number | MFCD00003348 |
| SMILES | C1=CC(=CC(=C1)F)C=O |
| Synonym | m-fluorobenzaldehyde,benzaldehyde, 3-fluoro,3'-fluoro-benzaldehyde,3-fluoro-benzaldehyde,meta-fluorobenzaldehyde,benzaldehyde, m-fluoro,3-fc6h4cho,3-fluorobenzaldehyde,3-fluoro benzaldehyde,pubchem3477 |
| IUPAC Name | 3-fluorobenzaldehyde |
| InChI Key | PIKNVEVCWAAOMJ-UHFFFAOYSA-N |
| Molecular Formula | C7H5FO |
4-Fluorophenylboronic Acid (contains varying amounts of Anhydride), TCI America™
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| PubChem CID | 285645 |
|---|---|
| CAS | 1765-93-1 |
| Molecular Weight (g/mol) | 139.92 |
| ChEBI | CHEBI:48661 |
| MDL Number | MFCD00039136 |
| Physical Form | Crystalline Powder |
| TSCA | No |
| IUPAC Name | (4-fluorophenyl)boronic acid |
| InChI Key | LBUNNMJLXWQQBY-UHFFFAOYSA-N |
| Molecular Formula | C6H6BFO2 |
| Formula Weight | 139.92 |
| Melting Point | 265°C |
Flubendazole 98.0+%, TCI America™
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CAS: 31430-15-6 Molecular Formula: C16H12FN3O3 Molecular Weight (g/mol): 313.288 MDL Number: MFCD00871999 InChI Key: CPEUVMUXAHMANV-UHFFFAOYSA-N Synonym: flubendazole,flumoxane,flubendazol,fluvermal,flubenol,flubendazolum,flumoxal,flutelmium,methyl 5-4-fluorobenzoyl-1h-benzo d imidazol-2-yl carbamate,flubendazol inn-spanish PubChem CID: 35802 ChEBI: CHEBI:77095 IUPAC Name: methyl N-[6-(4-fluorobenzoyl)-1H-benzimidazol-2-yl]carbamate SMILES: COC(=O)NC1=NC2=C(N1)C=C(C=C2)C(=O)C3=CC=C(C=C3)F
| PubChem CID | 35802 |
|---|---|
| CAS | 31430-15-6 |
| Molecular Weight (g/mol) | 313.288 |
| ChEBI | CHEBI:77095 |
| MDL Number | MFCD00871999 |
| SMILES | COC(=O)NC1=NC2=C(N1)C=C(C=C2)C(=O)C3=CC=C(C=C3)F |
| Synonym | flubendazole,flumoxane,flubendazol,fluvermal,flubenol,flubendazolum,flumoxal,flutelmium,methyl 5-4-fluorobenzoyl-1h-benzo d imidazol-2-yl carbamate,flubendazol inn-spanish |
| IUPAC Name | methyl N-[6-(4-fluorobenzoyl)-1H-benzimidazol-2-yl]carbamate |
| InChI Key | CPEUVMUXAHMANV-UHFFFAOYSA-N |
| Molecular Formula | C16H12FN3O3 |
4-Fluorobenzyl Mercaptan 95.0+%, TCI America™
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CAS: 15894-04-9 Molecular Formula: C7H7FS Molecular Weight (g/mol): 142.191 MDL Number: MFCD00040724 InChI Key: RKTRHMNWVZRZJQ-UHFFFAOYSA-N Synonym: 4-fluorobenzyl mercaptan,4-fluorophenyl methanethiol,4-fluorobenzylmercaptan,4-fluoro benzyl mercaptan,4-fluorobenzenemethanethiol,p-fluorotoluene-alpha-thiol,benzenemethanethiol, 4-fluoro,4-fluoro-phenyl-methanethiol,4-fluorobenzylthiol,4-fluorobenzyl thiol PubChem CID: 85171 IUPAC Name: (4-fluorophenyl)methanethiol SMILES: C1=CC(=CC=C1CS)F
| PubChem CID | 85171 |
|---|---|
| CAS | 15894-04-9 |
| Molecular Weight (g/mol) | 142.191 |
| MDL Number | MFCD00040724 |
| SMILES | C1=CC(=CC=C1CS)F |
| Synonym | 4-fluorobenzyl mercaptan,4-fluorophenyl methanethiol,4-fluorobenzylmercaptan,4-fluoro benzyl mercaptan,4-fluorobenzenemethanethiol,p-fluorotoluene-alpha-thiol,benzenemethanethiol, 4-fluoro,4-fluoro-phenyl-methanethiol,4-fluorobenzylthiol,4-fluorobenzyl thiol |
| IUPAC Name | (4-fluorophenyl)methanethiol |
| InChI Key | RKTRHMNWVZRZJQ-UHFFFAOYSA-N |
| Molecular Formula | C7H7FS |
2-Fluoro-5-iodotoluene 98.0+%, TCI America™
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CAS: 452-68-6 Molecular Formula: C7H6FI Molecular Weight (g/mol): 236.028 MDL Number: MFCD00013710 InChI Key: DYQIYXDSKUUZRI-UHFFFAOYSA-N Synonym: 2-fluoro-5-iodotoluene,benzene, 1-fluoro-4-iodo-2-methyl,1-fluoro-4-iodo-2-methyl-benzene,pubchem1619,2-fluoro-5-iodootoluene,acmc-20a0l4,ksc493m8f,4-fluoro-3-methyl-iodobenzene,buttpark 45\01-60 PubChem CID: 521178 IUPAC Name: 1-fluoro-4-iodo-2-methylbenzene SMILES: CC1=C(C=CC(=C1)I)F
| PubChem CID | 521178 |
|---|---|
| CAS | 452-68-6 |
| Molecular Weight (g/mol) | 236.028 |
| MDL Number | MFCD00013710 |
| SMILES | CC1=C(C=CC(=C1)I)F |
| Synonym | 2-fluoro-5-iodotoluene,benzene, 1-fluoro-4-iodo-2-methyl,1-fluoro-4-iodo-2-methyl-benzene,pubchem1619,2-fluoro-5-iodootoluene,acmc-20a0l4,ksc493m8f,4-fluoro-3-methyl-iodobenzene,buttpark 45\01-60 |
| IUPAC Name | 1-fluoro-4-iodo-2-methylbenzene |
| InChI Key | DYQIYXDSKUUZRI-UHFFFAOYSA-N |
| Molecular Formula | C7H6FI |
(4-Nitrophenyl)urea 98.0+%, TCI America™
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CAS: 556-10-5 Molecular Formula: C7H7N3O3 Molecular Weight (g/mol): 181.151 MDL Number: MFCD09040599 InChI Key: LXXTVGKSGJADFU-UHFFFAOYSA-N PubChem CID: 313520 IUPAC Name: (4-nitrophenyl)urea SMILES: C1=CC(=CC=C1NC(=O)N)[N+](=O)[O-]
| PubChem CID | 313520 |
|---|---|
| CAS | 556-10-5 |
| Molecular Weight (g/mol) | 181.151 |
| MDL Number | MFCD09040599 |
| SMILES | C1=CC(=CC=C1NC(=O)N)[N+](=O)[O-] |
| IUPAC Name | (4-nitrophenyl)urea |
| InChI Key | LXXTVGKSGJADFU-UHFFFAOYSA-N |
| Molecular Formula | C7H7N3O3 |
4-Iodo-3-nitrobenzoic Acid 97.0+%, TCI America™
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CAS: 35674-27-2 Molecular Formula: C7H4INO4 Molecular Weight (g/mol): 293.02 MDL Number: MFCD00502399 InChI Key: DNMTZLCNLAIKQC-UHFFFAOYSA-N Synonym: 4-iodo-3-nitrobenzoic acid,4-iodo-3-nitrobenzoicacid,3-nitro-4-iodobenzoic acid,4-iodo-3-nitro-benzoic acid,benzoic acid, 4-iodo-3-nitro,pubchem13471,acmc-209z8y,4-iodo-3-nitro benzoic acid PubChem CID: 11208598 IUPAC Name: 4-iodo-3-nitrobenzoic acid SMILES: OC(=O)C1=CC(=C(I)C=C1)[N+]([O-])=O
| PubChem CID | 11208598 |
|---|---|
| CAS | 35674-27-2 |
| Molecular Weight (g/mol) | 293.02 |
| MDL Number | MFCD00502399 |
| SMILES | OC(=O)C1=CC(=C(I)C=C1)[N+]([O-])=O |
| Synonym | 4-iodo-3-nitrobenzoic acid,4-iodo-3-nitrobenzoicacid,3-nitro-4-iodobenzoic acid,4-iodo-3-nitro-benzoic acid,benzoic acid, 4-iodo-3-nitro,pubchem13471,acmc-209z8y,4-iodo-3-nitro benzoic acid |
| IUPAC Name | 4-iodo-3-nitrobenzoic acid |
| InChI Key | DNMTZLCNLAIKQC-UHFFFAOYSA-N |
| Molecular Formula | C7H4INO4 |
4-Chloro-2-nitrotoluene, TCI America™
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CAS: 89-59-8 Molecular Formula: C7H6ClNO2 Molecular Weight (g/mol): 171.58 MDL Number: MFCD00007215 InChI Key: SQFLFRQWPBEDHM-UHFFFAOYSA-N Synonym: 4-chloro-2-nitrotoluene,2-nitro-4-chlorotoluene,benzene, 4-chloro-1-methyl-2-nitro,4,2-chloronitrotoluene,p-chloro-o-nitrotoluene,toluene, 4-chloro-2-nitro,4-chloro-1-methyl-2-nitro-benzene,ccris 3116,4-chlor-2-nitrotoluol,pubchem18919 PubChem CID: 6975 IUPAC Name: 4-chloro-1-methyl-2-nitrobenzene SMILES: CC1=CC=C(Cl)C=C1[N+]([O-])=O
| PubChem CID | 6975 |
|---|---|
| CAS | 89-59-8 |
| Molecular Weight (g/mol) | 171.58 |
| MDL Number | MFCD00007215 |
| SMILES | CC1=CC=C(Cl)C=C1[N+]([O-])=O |
| Synonym | 4-chloro-2-nitrotoluene,2-nitro-4-chlorotoluene,benzene, 4-chloro-1-methyl-2-nitro,4,2-chloronitrotoluene,p-chloro-o-nitrotoluene,toluene, 4-chloro-2-nitro,4-chloro-1-methyl-2-nitro-benzene,ccris 3116,4-chlor-2-nitrotoluol,pubchem18919 |
| IUPAC Name | 4-chloro-1-methyl-2-nitrobenzene |
| InChI Key | SQFLFRQWPBEDHM-UHFFFAOYSA-N |
| Molecular Formula | C7H6ClNO2 |
2-Chlorothioanisole 98.0+%, TCI America™
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CAS: 17733-22-1 Molecular Formula: C7H7ClS Molecular Weight (g/mol): 158.64 MDL Number: MFCD00040124 InChI Key: IHLDFHCSSCVPQW-UHFFFAOYSA-N Synonym: 2-Chlorophenyl Methyl Sulfide, 1-Chloro-2-(methylthio)benzene PubChem CID: 2737363 IUPAC Name: 1-chloro-2-(methylsulfanyl)benzene SMILES: CSC1=CC=CC=C1Cl
| PubChem CID | 2737363 |
|---|---|
| CAS | 17733-22-1 |
| Molecular Weight (g/mol) | 158.64 |
| MDL Number | MFCD00040124 |
| SMILES | CSC1=CC=CC=C1Cl |
| Synonym | 2-Chlorophenyl Methyl Sulfide, 1-Chloro-2-(methylthio)benzene |
| IUPAC Name | 1-chloro-2-(methylsulfanyl)benzene |
| InChI Key | IHLDFHCSSCVPQW-UHFFFAOYSA-N |
| Molecular Formula | C7H7ClS |
2,4,5-Trifluorophenylacetic Acid 98.0+%, TCI America™
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CAS: 209995-38-0 Molecular Formula: C8H5F3O2 Molecular Weight (g/mol): 190.12 MDL Number: MFCD00082479 InChI Key: YSQLGGQUQDTBSL-UHFFFAOYSA-N Synonym: 2,4,5-trifluorophenylacetic acid,2-2,4,5-trifluorophenyl acetic acid,2,4,5-trifluorophenyl acetic acid,2,4,5-trifluoro-phenyl-acetic acid,2,4,5-trifluorophenylaceticacid,2,4,5-trifluoro phenyl acetic acid,benzeneacetic acid, 2,4,5-trifluoro,pubchem3526,pubchem7287 PubChem CID: 2777950 IUPAC Name: 2-(2,4,5-trifluorophenyl)acetic acid SMILES: OC(=O)CC1=CC(F)=C(F)C=C1F
| PubChem CID | 2777950 |
|---|---|
| CAS | 209995-38-0 |
| Molecular Weight (g/mol) | 190.12 |
| MDL Number | MFCD00082479 |
| SMILES | OC(=O)CC1=CC(F)=C(F)C=C1F |
| Synonym | 2,4,5-trifluorophenylacetic acid,2-2,4,5-trifluorophenyl acetic acid,2,4,5-trifluorophenyl acetic acid,2,4,5-trifluoro-phenyl-acetic acid,2,4,5-trifluorophenylaceticacid,2,4,5-trifluoro phenyl acetic acid,benzeneacetic acid, 2,4,5-trifluoro,pubchem3526,pubchem7287 |
| IUPAC Name | 2-(2,4,5-trifluorophenyl)acetic acid |
| InChI Key | YSQLGGQUQDTBSL-UHFFFAOYSA-N |
| Molecular Formula | C8H5F3O2 |
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 |
2,7-Bis(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-9,9-didecylfluorene 98.0+%, TCI America™
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CAS: 711026-06-1 Molecular Formula: C45H72B2O4 Molecular Weight (g/mol): 698.687 MDL Number: MFCD20275090 InChI Key: AGCVTNPCAYFDNL-UHFFFAOYSA-N Synonym: 9,9-Didecylfluorene-2,7-diboronic Acid Bis(pinacol) Ester PubChem CID: 51341875 IUPAC Name: 2-[9,9-didecyl-7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)fluoren-2-yl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane SMILES: B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)C4=C(C3(CCCCCCCCCC)CCCCCCCCCC)C=C(C=C4)B5OC(C(O5)(C)C)(C)C
| PubChem CID | 51341875 |
|---|---|
| CAS | 711026-06-1 |
| Molecular Weight (g/mol) | 698.687 |
| MDL Number | MFCD20275090 |
| SMILES | B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)C4=C(C3(CCCCCCCCCC)CCCCCCCCCC)C=C(C=C4)B5OC(C(O5)(C)C)(C)C |
| Synonym | 9,9-Didecylfluorene-2,7-diboronic Acid Bis(pinacol) Ester |
| IUPAC Name | 2-[9,9-didecyl-7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)fluoren-2-yl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane |
| InChI Key | AGCVTNPCAYFDNL-UHFFFAOYSA-N |
| Molecular Formula | C45H72B2O4 |
2,4,6-Tri-tert-butylaniline 98.0+%, TCI America™
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CAS: 961-38-6 Molecular Formula: C18H31N Molecular Weight (g/mol): 261.453 MDL Number: MFCD00011645 InChI Key: REJGDSCBQPJPQT-UHFFFAOYSA-N Synonym: 2,4,6-tri-tert-butylaniline,2,4,6-tri-t-butylaniline,2,4,6-tri tert-butyl aniline,aniline, tri-tert-butyl,2,4,6-tri-tert-butylphenylamine,2,4,6-tritert-butylphenylamine,benzenamine, 2,4,6-tris 1,1-dimethylethyl,aniline, 2,4,6-tri-tert-butyl,2,4,6-tris tert-butyl phenylamine,pubchem16758 PubChem CID: 70402 IUPAC Name: 2,4,6-tritert-butylaniline SMILES: CC(C)(C)C1=CC(=C(C(=C1)C(C)(C)C)N)C(C)(C)C
| PubChem CID | 70402 |
|---|---|
| CAS | 961-38-6 |
| Molecular Weight (g/mol) | 261.453 |
| MDL Number | MFCD00011645 |
| SMILES | CC(C)(C)C1=CC(=C(C(=C1)C(C)(C)C)N)C(C)(C)C |
| Synonym | 2,4,6-tri-tert-butylaniline,2,4,6-tri-t-butylaniline,2,4,6-tri tert-butyl aniline,aniline, tri-tert-butyl,2,4,6-tri-tert-butylphenylamine,2,4,6-tritert-butylphenylamine,benzenamine, 2,4,6-tris 1,1-dimethylethyl,aniline, 2,4,6-tri-tert-butyl,2,4,6-tris tert-butyl phenylamine,pubchem16758 |
| IUPAC Name | 2,4,6-tritert-butylaniline |
| InChI Key | REJGDSCBQPJPQT-UHFFFAOYSA-N |
| Molecular Formula | C18H31N |