Benzenoids
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Ethyl 4-Phenoxybutyrate 96.0+%, TCI America™
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CAS: 2364-59-2 Molecular Formula: C12H16O3 Molecular Weight (g/mol): 208.257 MDL Number: MFCD01321182 InChI Key: XSVIVXBQBFMYCS-UHFFFAOYSA-N Synonym: 4-Phenoxybutyric Acid Ethyl Ester PubChem CID: 222539 IUPAC Name: ethyl 4-phenoxybutanoate SMILES: CCOC(=O)CCCOC1=CC=CC=C1
| PubChem CID | 222539 |
|---|---|
| CAS | 2364-59-2 |
| Molecular Weight (g/mol) | 208.257 |
| MDL Number | MFCD01321182 |
| SMILES | CCOC(=O)CCCOC1=CC=CC=C1 |
| Synonym | 4-Phenoxybutyric Acid Ethyl Ester |
| IUPAC Name | ethyl 4-phenoxybutanoate |
| InChI Key | XSVIVXBQBFMYCS-UHFFFAOYSA-N |
| Molecular Formula | C12H16O3 |
4-Cyano-4'-undecylbiphenyl 98.0+%, TCI America™
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CAS: 65860-74-4 Molecular Formula: C24H31N Molecular Weight (g/mol): 333.519 MDL Number: MFCD00505991 InChI Key: YIJBPYUXIFSTAP-UHFFFAOYSA-N Synonym: 4′C-Undecyl-4-biphenylcarbonitrile, 4′C-Undecyl-[1,1′C-biphenyl]-4-carbonitrile, 11CB PubChem CID: 105224 IUPAC Name: 4-(4-undecylphenyl)benzonitrile SMILES: CCCCCCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C#N
| PubChem CID | 105224 |
|---|---|
| CAS | 65860-74-4 |
| Molecular Weight (g/mol) | 333.519 |
| MDL Number | MFCD00505991 |
| SMILES | CCCCCCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C#N |
| Synonym | 4′C-Undecyl-4-biphenylcarbonitrile, 4′C-Undecyl-[1,1′C-biphenyl]-4-carbonitrile, 11CB |
| IUPAC Name | 4-(4-undecylphenyl)benzonitrile |
| InChI Key | YIJBPYUXIFSTAP-UHFFFAOYSA-N |
| Molecular Formula | C24H31N |
4-Benzyloxybenzyl Alcohol 95.0+%, TCI America™
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CAS: 836-43-1 Molecular Formula: C14H14O2 Molecular Weight (g/mol): 214.26 MDL Number: MFCD00004654 InChI Key: OEBIVOHKFYSBPE-UHFFFAOYSA-N Synonym: 4-benzyloxybenzyl alcohol,4-benzyloxy phenyl methanol,p-benzyloxybenzyl alcohol,4-benzyloxybenzylalcohol,4-benzyloxy benzyl alcohol,benzenemethanol, 4-phenylmethoxy,p-alkoxybenzyl alcohol resin,4-phenylmethoxyphenyl methanol,argopore-wang PubChem CID: 70043 ChEBI: CHEBI:29486 IUPAC Name: [4-(benzyloxy)phenyl]methanol SMILES: OCC1=CC=C(OCC2=CC=CC=C2)C=C1
| PubChem CID | 70043 |
|---|---|
| CAS | 836-43-1 |
| Molecular Weight (g/mol) | 214.26 |
| ChEBI | CHEBI:29486 |
| MDL Number | MFCD00004654 |
| SMILES | OCC1=CC=C(OCC2=CC=CC=C2)C=C1 |
| Synonym | 4-benzyloxybenzyl alcohol,4-benzyloxy phenyl methanol,p-benzyloxybenzyl alcohol,4-benzyloxybenzylalcohol,4-benzyloxy benzyl alcohol,benzenemethanol, 4-phenylmethoxy,p-alkoxybenzyl alcohol resin,4-phenylmethoxyphenyl methanol,argopore-wang |
| IUPAC Name | [4-(benzyloxy)phenyl]methanol |
| InChI Key | OEBIVOHKFYSBPE-UHFFFAOYSA-N |
| Molecular Formula | C14H14O2 |
Bis[4-(dimethylamino)phenyl]methane 98.0+%, TCI America™
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CAS: 101-61-1 Molecular Formula: C17H22N2 Molecular Weight (g/mol): 254.377 MDL Number: MFCD00008317 InChI Key: JNRLEMMIVRBKJE-UHFFFAOYSA-N Synonym: 4,4'-methylenebis n,n-dimethylaniline,tetra-base,tetrabase,michler's base,methane base,methylene base,michler's hydride,michler's methane,4,4'-bis dimethylamino diphenylmethane,reduced michler's ketone PubChem CID: 7567 ChEBI: CHEBI:34370 IUPAC Name: 4-[[4-(dimethylamino)phenyl]methyl]-N,N-dimethylaniline SMILES: CN(C)C1=CC=C(C=C1)CC2=CC=C(C=C2)N(C)C
| PubChem CID | 7567 |
|---|---|
| CAS | 101-61-1 |
| Molecular Weight (g/mol) | 254.377 |
| ChEBI | CHEBI:34370 |
| MDL Number | MFCD00008317 |
| SMILES | CN(C)C1=CC=C(C=C1)CC2=CC=C(C=C2)N(C)C |
| Synonym | 4,4'-methylenebis n,n-dimethylaniline,tetra-base,tetrabase,michler's base,methane base,methylene base,michler's hydride,michler's methane,4,4'-bis dimethylamino diphenylmethane,reduced michler's ketone |
| IUPAC Name | 4-[[4-(dimethylamino)phenyl]methyl]-N,N-dimethylaniline |
| InChI Key | JNRLEMMIVRBKJE-UHFFFAOYSA-N |
| Molecular Formula | C17H22N2 |
4-Bromostyrene (stabilized with TBC) 95.0+%, TCI America™
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CAS: 2039-82-9 Molecular Formula: C8H7Br Molecular Weight (g/mol): 183.05 MDL Number: MFCD00000110 InChI Key: WGGLDBIZIQMEGH-UHFFFAOYSA-N Synonym: 4-bromostyrene,1-bromo-4-vinylbenzene,p-bromostyrene,benzene, 1-bromo-4-ethenyl,styrene, p-bromo,1-4-bromophenyl ethylene,unii-tvk4s80xlu,p-bromo styrene,1-bromo-4-vinyl-benzene,tvk4s80xlu PubChem CID: 16263 IUPAC Name: 1-bromo-4-ethenylbenzene SMILES: BrC1=CC=C(C=C)C=C1
| PubChem CID | 16263 |
|---|---|
| CAS | 2039-82-9 |
| Molecular Weight (g/mol) | 183.05 |
| MDL Number | MFCD00000110 |
| SMILES | BrC1=CC=C(C=C)C=C1 |
| Synonym | 4-bromostyrene,1-bromo-4-vinylbenzene,p-bromostyrene,benzene, 1-bromo-4-ethenyl,styrene, p-bromo,1-4-bromophenyl ethylene,unii-tvk4s80xlu,p-bromo styrene,1-bromo-4-vinyl-benzene,tvk4s80xlu |
| IUPAC Name | 1-bromo-4-ethenylbenzene |
| InChI Key | WGGLDBIZIQMEGH-UHFFFAOYSA-N |
| Molecular Formula | C8H7Br |
(2-Fluorophenyl)thiourea 98.0+%, TCI America™
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CAS: 656-32-6 Molecular Formula: C7H7FN2S Molecular Weight (g/mol): 170.205 MDL Number: MFCD00041148 InChI Key: WYVZQQOFMQRNPF-UHFFFAOYSA-N Synonym: 1-2-fluorophenyl thiourea,2-fluorophenyl thiourea,1-2-fluorophenyl-2-thiourea,thiourea, 2-fluorophenyl,n-2-fluorophenyl thiourea,amino 2-fluorophenyl amino methane-1-thione,maybridge1_008774,acmc-1b7vs,2-fluoro-phenyl-thiourea PubChem CID: 2737500 IUPAC Name: (2-fluorophenyl)thiourea SMILES: C1=CC=C(C(=C1)NC(=S)N)F
| PubChem CID | 2737500 |
|---|---|
| CAS | 656-32-6 |
| Molecular Weight (g/mol) | 170.205 |
| MDL Number | MFCD00041148 |
| SMILES | C1=CC=C(C(=C1)NC(=S)N)F |
| Synonym | 1-2-fluorophenyl thiourea,2-fluorophenyl thiourea,1-2-fluorophenyl-2-thiourea,thiourea, 2-fluorophenyl,n-2-fluorophenyl thiourea,amino 2-fluorophenyl amino methane-1-thione,maybridge1_008774,acmc-1b7vs,2-fluoro-phenyl-thiourea |
| IUPAC Name | (2-fluorophenyl)thiourea |
| InChI Key | WYVZQQOFMQRNPF-UHFFFAOYSA-N |
| Molecular Formula | C7H7FN2S |
2-Fluoro-4-methoxyphenol 95.0+%, TCI America™
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CAS: 167683-93-4 Molecular Formula: C7H7FO2 Molecular Weight (g/mol): 142.129 MDL Number: MFCD00070796 InChI Key: FCJHBXCQIOVMEM-UHFFFAOYSA-N Synonym: 3-Fluoro-4-hydroxyanisole PubChem CID: 2774557 IUPAC Name: 2-fluoro-4-methoxyphenol SMILES: COC1=CC(=C(C=C1)O)F
| PubChem CID | 2774557 |
|---|---|
| CAS | 167683-93-4 |
| Molecular Weight (g/mol) | 142.129 |
| MDL Number | MFCD00070796 |
| SMILES | COC1=CC(=C(C=C1)O)F |
| Synonym | 3-Fluoro-4-hydroxyanisole |
| IUPAC Name | 2-fluoro-4-methoxyphenol |
| InChI Key | FCJHBXCQIOVMEM-UHFFFAOYSA-N |
| Molecular Formula | C7H7FO2 |
Acenaphthenequinone Dioxime, TCI America™
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CAS: 8-7-1932 Molecular Formula: C12H8N2O2 Molecular Weight (g/mol): 212.21 MDL Number: MFCD00059513 InChI Key: DFVXPXWNTZFHIV-UHFFFAOYSA-N PubChem CID: 233285 IUPAC Name: N-(2-nitrosoacenaphthylen-1-yl)hydroxylamine SMILES: C1=CC2=C3C(=C1)C(=C(C3=CC=C2)N=O)NO
| PubChem CID | 233285 |
|---|---|
| CAS | 8-7-1932 |
| Molecular Weight (g/mol) | 212.21 |
| MDL Number | MFCD00059513 |
| SMILES | C1=CC2=C3C(=C1)C(=C(C3=CC=C2)N=O)NO |
| IUPAC Name | N-(2-nitrosoacenaphthylen-1-yl)hydroxylamine |
| InChI Key | DFVXPXWNTZFHIV-UHFFFAOYSA-N |
| Molecular Formula | C12H8N2O2 |
Carbonylbis(triphenylphosphine)rhodium(I) Chloride, TCI America™
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CAS: 13938-94-8 Molecular Formula: C37H30ClOP2Rh Molecular Weight (g/mol): 690.95 MDL Number: MFCD00044273 InChI Key: NGAGFUUIULZUPO-UHFFFAOYSA-M Synonym: Bis(triphenylphosphine)carbonylrhodium(I) Chloride, Carbonylchlorobis(triphenylphosphine)rhodium(I) PubChem CID: 131667324 IUPAC Name: chlororhodiumylium; methanidylidyneoxidanium; bis(triphenylphosphane) SMILES: Cl[Rh+].[C-]#[O+].C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=CC=C1.C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=CC=C1
| PubChem CID | 131667324 |
|---|---|
| CAS | 13938-94-8 |
| Molecular Weight (g/mol) | 690.95 |
| MDL Number | MFCD00044273 |
| SMILES | Cl[Rh+].[C-]#[O+].C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=CC=C1.C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=CC=C1 |
| Synonym | Bis(triphenylphosphine)carbonylrhodium(I) Chloride, Carbonylchlorobis(triphenylphosphine)rhodium(I) |
| IUPAC Name | chlororhodiumylium; methanidylidyneoxidanium; bis(triphenylphosphane) |
| InChI Key | NGAGFUUIULZUPO-UHFFFAOYSA-M |
| Molecular Formula | C37H30ClOP2Rh |
Benzyl Methyl Ether 97.0+%, TCI America™
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CAS: 538-86-3 Molecular Formula: C8H10O Molecular Weight (g/mol): 122.167 MDL Number: MFCD00025901 InChI Key: GQKZBCPTCWJTAS-UHFFFAOYSA-N Synonym: benzyl methyl ether,methoxymethyl benzene,methyl benzyl ether,benzene, methoxymethyl,ether, benzyl methyl,benzylmethylether,unii-f22rls78bd,.alpha.-methoxytoluene,f22rls78bd,methoxyphenylmethane PubChem CID: 10869 IUPAC Name: methoxymethylbenzene SMILES: COCC1=CC=CC=C1
| PubChem CID | 10869 |
|---|---|
| CAS | 538-86-3 |
| Molecular Weight (g/mol) | 122.167 |
| MDL Number | MFCD00025901 |
| SMILES | COCC1=CC=CC=C1 |
| Synonym | benzyl methyl ether,methoxymethyl benzene,methyl benzyl ether,benzene, methoxymethyl,ether, benzyl methyl,benzylmethylether,unii-f22rls78bd,.alpha.-methoxytoluene,f22rls78bd,methoxyphenylmethane |
| IUPAC Name | methoxymethylbenzene |
| InChI Key | GQKZBCPTCWJTAS-UHFFFAOYSA-N |
| Molecular Formula | C8H10O |
4-Nitrobenzophenone 99.0+%, TCI America™
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CAS: 1144-74-7 Molecular Formula: C13H9NO3 Molecular Weight (g/mol): 227.22 MDL Number: MFCD00007354 InChI Key: ZYMCBJWUWHHVRX-UHFFFAOYSA-N Synonym: 4-nitrobenzophenone,p-nitrobenzophenone,4-nitrophenyl phenyl methanone,benzophenone, 4-nitro,methanone, 4-nitrophenyl phenyl,4-nitrophenyl phenyl ketone,4-nitrophenyl-phenylmethanone,4-nitrophenyl-phenyl-methanone,4-nitro-benzophenone PubChem CID: 70839 IUPAC Name: (4-nitrophenyl)(phenyl)methanone SMILES: [O-][N+](=O)C1=CC=C(C=C1)C(=O)C1=CC=CC=C1
| PubChem CID | 70839 |
|---|---|
| CAS | 1144-74-7 |
| Molecular Weight (g/mol) | 227.22 |
| MDL Number | MFCD00007354 |
| SMILES | [O-][N+](=O)C1=CC=C(C=C1)C(=O)C1=CC=CC=C1 |
| Synonym | 4-nitrobenzophenone,p-nitrobenzophenone,4-nitrophenyl phenyl methanone,benzophenone, 4-nitro,methanone, 4-nitrophenyl phenyl,4-nitrophenyl phenyl ketone,4-nitrophenyl-phenylmethanone,4-nitrophenyl-phenyl-methanone,4-nitro-benzophenone |
| IUPAC Name | (4-nitrophenyl)(phenyl)methanone |
| InChI Key | ZYMCBJWUWHHVRX-UHFFFAOYSA-N |
| Molecular Formula | C13H9NO3 |
2-Fluorobenzamide 98.0+%, TCI America™
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CAS: 445-28-3 Molecular Formula: C7H6FNO Molecular Weight (g/mol): 139.129 MDL Number: MFCD00007970 InChI Key: KGGHWIKBOIQEAJ-UHFFFAOYSA-N Synonym: o-fluorobenzamide,benzamide, 2-fluoro,benzamide, o-fluoro,o-fluorobenzoic acid amide,ortho-fluorobenzamide,fluorobenzamide,2-fluoro-benzamide,pubchem3405,acmc-1aljb,2-fluorobenzamide PubChem CID: 67964 IUPAC Name: 2-fluorobenzamide SMILES: C1=CC=C(C(=C1)C(=O)N)F
| PubChem CID | 67964 |
|---|---|
| CAS | 445-28-3 |
| Molecular Weight (g/mol) | 139.129 |
| MDL Number | MFCD00007970 |
| SMILES | C1=CC=C(C(=C1)C(=O)N)F |
| Synonym | o-fluorobenzamide,benzamide, 2-fluoro,benzamide, o-fluoro,o-fluorobenzoic acid amide,ortho-fluorobenzamide,fluorobenzamide,2-fluoro-benzamide,pubchem3405,acmc-1aljb,2-fluorobenzamide |
| IUPAC Name | 2-fluorobenzamide |
| InChI Key | KGGHWIKBOIQEAJ-UHFFFAOYSA-N |
| Molecular Formula | C7H6FNO |
3-Bromobenzoyl Chloride 98.0+%, TCI America™
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CAS: 1711-09-7 Molecular Formula: C7H4BrClO Molecular Weight (g/mol): 219.462 MDL Number: MFCD00000669 InChI Key: PBOOZQFGWNZNQE-UHFFFAOYSA-N Synonym: m-bromobenzoyl chloride,benzoyl chloride, 3-bromo,3-bromobenzoylchloride,benzoyl chloride, m-bromo,3-bromobenzoic acid chloride,attercop-chm at106527,3-brom-benzoylchlorid,3-bromo-benzoylchlorid,3-bromobenzoic chloride,pubchem13574 PubChem CID: 74377 IUPAC Name: 3-bromobenzoyl chloride SMILES: C1=CC(=CC(=C1)Br)C(=O)Cl
| PubChem CID | 74377 |
|---|---|
| CAS | 1711-09-7 |
| Molecular Weight (g/mol) | 219.462 |
| MDL Number | MFCD00000669 |
| SMILES | C1=CC(=CC(=C1)Br)C(=O)Cl |
| Synonym | m-bromobenzoyl chloride,benzoyl chloride, 3-bromo,3-bromobenzoylchloride,benzoyl chloride, m-bromo,3-bromobenzoic acid chloride,attercop-chm at106527,3-brom-benzoylchlorid,3-bromo-benzoylchlorid,3-bromobenzoic chloride,pubchem13574 |
| IUPAC Name | 3-bromobenzoyl chloride |
| InChI Key | PBOOZQFGWNZNQE-UHFFFAOYSA-N |
| Molecular Formula | C7H4BrClO |
2-Bromoethyl Phenyl Sulfide 97.0+%, TCI America™
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CAS: 4837-01-8 Molecular Formula: C8H9BrS Molecular Weight (g/mol): 217.12 MDL Number: MFCD00040826 InChI Key: UEFBOQYLXLEJSM-UHFFFAOYSA-N Synonym: 2-bromoethyl phenyl sulfide,2-bromoethyl thio benzene,2-bromoethyl phenyl sulfane,2-bromoethyl sulfanyl benzene,2-bromoethylthiobenzene,benzene, 2-bromoethyl thio,2-bromo-1-phenylthioethane,acmc-1aoyt,2-phenylthioethyl bromide PubChem CID: 78553 IUPAC Name: [(2-bromoethyl)sulfanyl]benzene SMILES: BrCCSC1=CC=CC=C1
| PubChem CID | 78553 |
|---|---|
| CAS | 4837-01-8 |
| Molecular Weight (g/mol) | 217.12 |
| MDL Number | MFCD00040826 |
| SMILES | BrCCSC1=CC=CC=C1 |
| Synonym | 2-bromoethyl phenyl sulfide,2-bromoethyl thio benzene,2-bromoethyl phenyl sulfane,2-bromoethyl sulfanyl benzene,2-bromoethylthiobenzene,benzene, 2-bromoethyl thio,2-bromo-1-phenylthioethane,acmc-1aoyt,2-phenylthioethyl bromide |
| IUPAC Name | [(2-bromoethyl)sulfanyl]benzene |
| InChI Key | UEFBOQYLXLEJSM-UHFFFAOYSA-N |
| Molecular Formula | C8H9BrS |
4-Iodobenzotrifluoride (stabilized with Copper chip) 97.0+%, TCI America™
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CAS: 455-13-0 Molecular Formula: C7H4F3I Molecular Weight (g/mol): 272.009 MDL Number: MFCD00039398 InChI Key: SKGRFPGOGCHDPC-UHFFFAOYSA-N Synonym: 4-iodobenzotrifluoride,1-iodo-4-trifluoromethyl benzene,p-iodobenzotrifluoride,benzene, 1-iodo-4-trifluoromethyl,4-trifluoromethyl iodobenzene,4-iodo-alpha,alpha,alpha-trifluorotoluene,alpha,alpha,alpha-trifluoro-4-iodotoluene,4-iodobenztrifluoride,4-iodobenzo trifluoride,4-iodo-1-trifluoromethylbenzene PubChem CID: 67993 IUPAC Name: 1-iodo-4-(trifluoromethyl)benzene SMILES: C1=CC(=CC=C1C(F)(F)F)I
| PubChem CID | 67993 |
|---|---|
| CAS | 455-13-0 |
| Molecular Weight (g/mol) | 272.009 |
| MDL Number | MFCD00039398 |
| SMILES | C1=CC(=CC=C1C(F)(F)F)I |
| Synonym | 4-iodobenzotrifluoride,1-iodo-4-trifluoromethyl benzene,p-iodobenzotrifluoride,benzene, 1-iodo-4-trifluoromethyl,4-trifluoromethyl iodobenzene,4-iodo-alpha,alpha,alpha-trifluorotoluene,alpha,alpha,alpha-trifluoro-4-iodotoluene,4-iodobenztrifluoride,4-iodobenzo trifluoride,4-iodo-1-trifluoromethylbenzene |
| IUPAC Name | 1-iodo-4-(trifluoromethyl)benzene |
| InChI Key | SKGRFPGOGCHDPC-UHFFFAOYSA-N |
| Molecular Formula | C7H4F3I |