Benzenoids
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2-Cinnamoylthiophene 98.0+%, TCI America™
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CAS: 3988-77-0 Molecular Formula: C13H10OS Molecular Weight (g/mol): 214.282 MDL Number: MFCD00059742 InChI Key: DDNPADUKGZMCHV-CMDGGOBGSA-N Synonym: 3-Phenyl-1-(2-thienyl)-2-propen-1-one, Styryl 2-Thienyl Ketone PubChem CID: 5702653 IUPAC Name: (E)-3-phenyl-1-thiophen-2-ylprop-2-en-1-one SMILES: C1=CC=C(C=C1)C=CC(=O)C2=CC=CS2
| PubChem CID | 5702653 |
|---|---|
| CAS | 3988-77-0 |
| Molecular Weight (g/mol) | 214.282 |
| MDL Number | MFCD00059742 |
| SMILES | C1=CC=C(C=C1)C=CC(=O)C2=CC=CS2 |
| Synonym | 3-Phenyl-1-(2-thienyl)-2-propen-1-one, Styryl 2-Thienyl Ketone |
| IUPAC Name | (E)-3-phenyl-1-thiophen-2-ylprop-2-en-1-one |
| InChI Key | DDNPADUKGZMCHV-CMDGGOBGSA-N |
| Molecular Formula | C13H10OS |
N-Phenyl-1-anthramine 98.0+%, TCI America™
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CAS: 98683-00-2 Molecular Formula: C20H15N Molecular Weight (g/mol): 269.347 InChI Key: QCOIZKZASBFCJG-UHFFFAOYSA-N Synonym: 1-Anilinoanthracene PubChem CID: 21444085 IUPAC Name: N-phenylanthracen-1-amine SMILES: C1=CC=C(C=C1)NC2=CC=CC3=CC4=CC=CC=C4C=C32
| PubChem CID | 21444085 |
|---|---|
| CAS | 98683-00-2 |
| Molecular Weight (g/mol) | 269.347 |
| SMILES | C1=CC=C(C=C1)NC2=CC=CC3=CC4=CC=CC=C4C=C32 |
| Synonym | 1-Anilinoanthracene |
| IUPAC Name | N-phenylanthracen-1-amine |
| InChI Key | QCOIZKZASBFCJG-UHFFFAOYSA-N |
| Molecular Formula | C20H15N |
m-Toluidine Hydrochloride 98.0+%, TCI America™
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CAS: 638-03-9 Molecular Formula: C7H10ClN Molecular Weight (g/mol): 143.614 MDL Number: MFCD00070607 InChI Key: VDXZPXIEEVOGLV-UHFFFAOYSA-N PubChem CID: 522105 IUPAC Name: 3-methylaniline;hydrochloride SMILES: CC1=CC(=CC=C1)N.Cl
| PubChem CID | 522105 |
|---|---|
| CAS | 638-03-9 |
| Molecular Weight (g/mol) | 143.614 |
| MDL Number | MFCD00070607 |
| SMILES | CC1=CC(=CC=C1)N.Cl |
| IUPAC Name | 3-methylaniline;hydrochloride |
| InChI Key | VDXZPXIEEVOGLV-UHFFFAOYSA-N |
| Molecular Formula | C7H10ClN |
4-Bromo-2-chloro-1-iodobenzene 97.0+%, TCI America™
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CAS: 31928-47-9 Molecular Formula: C6H3BrClI Molecular Weight (g/mol): 317.348 MDL Number: MFCD00079709 InChI Key: OHHKQBZOURGNLR-UHFFFAOYSA-N Synonym: 4-bromo-2-chloroiodobenzene,1-bromo-3-chloro-4-iodobenzene,benzene, 4-bromo-2-chloro-1-iodo,buttpark 34\07-78,4-bromo-2-chloro-1-iodo-benzene,pubchem3592,acmc-1cp6y,3-chloro-4-iodobromobenzene,ksc493m0p,4-bromo-2-chloro-iodobenzene PubChem CID: 2735547 IUPAC Name: 4-bromo-2-chloro-1-iodobenzene SMILES: C1=CC(=C(C=C1Br)Cl)I
| PubChem CID | 2735547 |
|---|---|
| CAS | 31928-47-9 |
| Molecular Weight (g/mol) | 317.348 |
| MDL Number | MFCD00079709 |
| SMILES | C1=CC(=C(C=C1Br)Cl)I |
| Synonym | 4-bromo-2-chloroiodobenzene,1-bromo-3-chloro-4-iodobenzene,benzene, 4-bromo-2-chloro-1-iodo,buttpark 34\07-78,4-bromo-2-chloro-1-iodo-benzene,pubchem3592,acmc-1cp6y,3-chloro-4-iodobromobenzene,ksc493m0p,4-bromo-2-chloro-iodobenzene |
| IUPAC Name | 4-bromo-2-chloro-1-iodobenzene |
| InChI Key | OHHKQBZOURGNLR-UHFFFAOYSA-N |
| Molecular Formula | C6H3BrClI |
3,4,5-Trimethoxytoluene 98.0+%, TCI America™
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CAS: 6443-69-2 Molecular Formula: C10H14O3 Molecular Weight (g/mol): 182.219 MDL Number: MFCD00008397 InChI Key: KCIZTNZGSBSSRM-UHFFFAOYSA-N Synonym: 3,4,5-trimethoxytoluene,benzene, 1,2,3-trimethoxy-5-methyl,5-methylpyrogallol trimethyl ether,1,2,3-trimethoxy-5-methyl-benzene,toluene, 3,4,5-trimethoxy,1,2,3-trimethoxy-5-methylbenzol,pubchem13665,acmc-209nm4,3,4,5-trimethoxy-toluene,3,4,5-trimethoxy toluene PubChem CID: 80922 ChEBI: CHEBI:81354 IUPAC Name: 1,2,3-trimethoxy-5-methylbenzene SMILES: CC1=CC(=C(C(=C1)OC)OC)OC
| PubChem CID | 80922 |
|---|---|
| CAS | 6443-69-2 |
| Molecular Weight (g/mol) | 182.219 |
| ChEBI | CHEBI:81354 |
| MDL Number | MFCD00008397 |
| SMILES | CC1=CC(=C(C(=C1)OC)OC)OC |
| Synonym | 3,4,5-trimethoxytoluene,benzene, 1,2,3-trimethoxy-5-methyl,5-methylpyrogallol trimethyl ether,1,2,3-trimethoxy-5-methyl-benzene,toluene, 3,4,5-trimethoxy,1,2,3-trimethoxy-5-methylbenzol,pubchem13665,acmc-209nm4,3,4,5-trimethoxy-toluene,3,4,5-trimethoxy toluene |
| IUPAC Name | 1,2,3-trimethoxy-5-methylbenzene |
| InChI Key | KCIZTNZGSBSSRM-UHFFFAOYSA-N |
| Molecular Formula | C10H14O3 |
9,10-Dibromoanthracene 98.0+%, TCI America™
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CAS: 523-27-3 Molecular Formula: C14H8Br2 Molecular Weight (g/mol): 336.026 MDL Number: MFCD00001244 InChI Key: BRUOAURMAFDGLP-UHFFFAOYSA-N Synonym: anthracene, 9,10-dibromo,9,10-dibromo-anthracene,unii-61cp7c5y82,9,10-dibromanthracen,9,10-dibromo anthracenen,pubchem15115,9,10 dibromoanthracene,anthracene,10-dibromo,9,10-dibromoanthracene,acmc-1az4y PubChem CID: 68226 IUPAC Name: 9,10-dibromoanthracene SMILES: C1=CC=C2C(=C1)C(=C3C=CC=CC3=C2Br)Br
| PubChem CID | 68226 |
|---|---|
| CAS | 523-27-3 |
| Molecular Weight (g/mol) | 336.026 |
| MDL Number | MFCD00001244 |
| SMILES | C1=CC=C2C(=C1)C(=C3C=CC=CC3=C2Br)Br |
| Synonym | anthracene, 9,10-dibromo,9,10-dibromo-anthracene,unii-61cp7c5y82,9,10-dibromanthracen,9,10-dibromo anthracenen,pubchem15115,9,10 dibromoanthracene,anthracene,10-dibromo,9,10-dibromoanthracene,acmc-1az4y |
| IUPAC Name | 9,10-dibromoanthracene |
| InChI Key | BRUOAURMAFDGLP-UHFFFAOYSA-N |
| Molecular Formula | C14H8Br2 |
4-Phenoxyaniline 98.0+%, TCI America™
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CAS: 139-59-3 Molecular Formula: C12H11NO Molecular Weight (g/mol): 185.226 MDL Number: MFCD00007862 InChI Key: WOYZXEVUWXQVNV-UHFFFAOYSA-N Synonym: p-phenoxyaniline,4-aminodiphenyl ether,benzenamine, 4-phenoxy,4-phenoxybenzenamine,4-aminophenyl phenyl ether,4-aminodifenylether,4-amino-1-phenoxybenzene,aniline, p-phenoxy,4-aminobiphenyl ether,4-aminodiphenylether PubChem CID: 8764 IUPAC Name: 4-phenoxyaniline SMILES: C1=CC=C(C=C1)OC2=CC=C(C=C2)N
| PubChem CID | 8764 |
|---|---|
| CAS | 139-59-3 |
| Molecular Weight (g/mol) | 185.226 |
| MDL Number | MFCD00007862 |
| SMILES | C1=CC=C(C=C1)OC2=CC=C(C=C2)N |
| Synonym | p-phenoxyaniline,4-aminodiphenyl ether,benzenamine, 4-phenoxy,4-phenoxybenzenamine,4-aminophenyl phenyl ether,4-aminodifenylether,4-amino-1-phenoxybenzene,aniline, p-phenoxy,4-aminobiphenyl ether,4-aminodiphenylether |
| IUPAC Name | 4-phenoxyaniline |
| InChI Key | WOYZXEVUWXQVNV-UHFFFAOYSA-N |
| Molecular Formula | C12H11NO |
3-Methyl-2-butenyl Benzoate 98.0+%, TCI America™
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CAS: 5205-11-8 Molecular Formula: C12H14O2 Molecular Weight (g/mol): 190.24 MDL Number: MFCD00036570 InChI Key: INVWRXWYYVMFQC-UHFFFAOYSA-N Synonym: Benzoic Acid 3-Methyl-2-butenyl Ester, Benzoic Acid Prenyl Ester, Prenyl Benzoate PubChem CID: 21265 IUPAC Name: 3-methylbut-2-enyl benzoate SMILES: CC(=CCOC(=O)C1=CC=CC=C1)C
| PubChem CID | 21265 |
|---|---|
| CAS | 5205-11-8 |
| Molecular Weight (g/mol) | 190.24 |
| MDL Number | MFCD00036570 |
| SMILES | CC(=CCOC(=O)C1=CC=CC=C1)C |
| Synonym | Benzoic Acid 3-Methyl-2-butenyl Ester, Benzoic Acid Prenyl Ester, Prenyl Benzoate |
| IUPAC Name | 3-methylbut-2-enyl benzoate |
| InChI Key | INVWRXWYYVMFQC-UHFFFAOYSA-N |
| Molecular Formula | C12H14O2 |
2,3,6-Trifluorobenzoic Acid 98.0+%, TCI America™
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CAS: 2358-29-4 Molecular Formula: C7H2F3O2 Molecular Weight (g/mol): 175.09 MDL Number: MFCD00002409 InChI Key: MGUPHQGQNHDGNK-UHFFFAOYSA-M Synonym: 2,5,6-trifluorobenzoic acid,2,3,6-trifluorobenzoicacid,2,3,6-trifluoro-benzoic acid,benzoic acid, 2,3,6-trifluoro,pubchem1344,intermediates-zcf02628,ksc494k2n,2,3,6-trifluoro benzoic acid,rarechem al bo 0267,2,3,6-trifluorobenzoic acid PubChem CID: 520062 IUPAC Name: 2,3,6-trifluorobenzoate SMILES: [O-]C(=O)C1=C(F)C=CC(F)=C1F
| PubChem CID | 520062 |
|---|---|
| CAS | 2358-29-4 |
| Molecular Weight (g/mol) | 175.09 |
| MDL Number | MFCD00002409 |
| SMILES | [O-]C(=O)C1=C(F)C=CC(F)=C1F |
| Synonym | 2,5,6-trifluorobenzoic acid,2,3,6-trifluorobenzoicacid,2,3,6-trifluoro-benzoic acid,benzoic acid, 2,3,6-trifluoro,pubchem1344,intermediates-zcf02628,ksc494k2n,2,3,6-trifluoro benzoic acid,rarechem al bo 0267,2,3,6-trifluorobenzoic acid |
| IUPAC Name | 2,3,6-trifluorobenzoate |
| InChI Key | MGUPHQGQNHDGNK-UHFFFAOYSA-M |
| Molecular Formula | C7H2F3O2 |
2-Phenylbutyrophenone 98.0+%, TCI America™
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CAS: 16282-16-9 Molecular Formula: C16H16O Molecular Weight (g/mol): 224.303 MDL Number: MFCD00010344 InChI Key: UHKJKVIZTFFFSB-UHFFFAOYSA-N Synonym: 1,2-diphenyl-1-butanone,alpha-ethyldeoxybenzoin,alpha-ethyl deoxybenzoin,2-phenylbutyrophenone,1,2-diphenyl-butan-1-one,1-butanone, 1,2-diphenyl,phenylbutyrophenone,pubchem20785,butyrophenone, 2-phenyl,1-butanone,1,2-diphenyl PubChem CID: 297636 IUPAC Name: 1,2-diphenylbutan-1-one SMILES: CCC(C1=CC=CC=C1)C(=O)C2=CC=CC=C2
| PubChem CID | 297636 |
|---|---|
| CAS | 16282-16-9 |
| Molecular Weight (g/mol) | 224.303 |
| MDL Number | MFCD00010344 |
| SMILES | CCC(C1=CC=CC=C1)C(=O)C2=CC=CC=C2 |
| Synonym | 1,2-diphenyl-1-butanone,alpha-ethyldeoxybenzoin,alpha-ethyl deoxybenzoin,2-phenylbutyrophenone,1,2-diphenyl-butan-1-one,1-butanone, 1,2-diphenyl,phenylbutyrophenone,pubchem20785,butyrophenone, 2-phenyl,1-butanone,1,2-diphenyl |
| IUPAC Name | 1,2-diphenylbutan-1-one |
| InChI Key | UHKJKVIZTFFFSB-UHFFFAOYSA-N |
| Molecular Formula | C16H16O |
4,4'-Diiodobiphenyl 98.0+%, TCI America™
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CAS: 3001-15-8 Molecular Formula: C12H8I2 Molecular Weight (g/mol): 406.005 MDL Number: MFCD00001057 InChI Key: GPYDMVZCPRONLW-UHFFFAOYSA-N Synonym: 4,4'-diiodobiphenyl,4,4'-diiodo-1,1'-biphenyl,4,4'-diiododiphenyl,1,1'-biphenyl, 4,4'-diiodo,1-iodo-4-4-iodophenyl benzene,4,4-diiodobiphenyl,4-4'-iodophenyl iodobenzene,4,4;-diiodobiphenyl,4,4'-diiododophenyl, pract,4-iodo-1-4-iodophenyl benzene PubChem CID: 76348 IUPAC Name: 1-iodo-4-(4-iodophenyl)benzene SMILES: C1=CC(=CC=C1C2=CC=C(C=C2)I)I
| PubChem CID | 76348 |
|---|---|
| CAS | 3001-15-8 |
| Molecular Weight (g/mol) | 406.005 |
| MDL Number | MFCD00001057 |
| SMILES | C1=CC(=CC=C1C2=CC=C(C=C2)I)I |
| Synonym | 4,4'-diiodobiphenyl,4,4'-diiodo-1,1'-biphenyl,4,4'-diiododiphenyl,1,1'-biphenyl, 4,4'-diiodo,1-iodo-4-4-iodophenyl benzene,4,4-diiodobiphenyl,4-4'-iodophenyl iodobenzene,4,4;-diiodobiphenyl,4,4'-diiododophenyl, pract,4-iodo-1-4-iodophenyl benzene |
| IUPAC Name | 1-iodo-4-(4-iodophenyl)benzene |
| InChI Key | GPYDMVZCPRONLW-UHFFFAOYSA-N |
| Molecular Formula | C12H8I2 |
Methyl 3,5-Di-tert-butylbenzoate 98.0+%, TCI America™
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CAS: 64277-87-8 Molecular Formula: C16H24O2 Molecular Weight (g/mol): 248.37 MDL Number: MFCD03844786 InChI Key: ZEIOQJMJXFVPOG-UHFFFAOYSA-N Synonym: 3,5-Di-tert-butylbenzoic Acid Methyl Ester PubChem CID: 13267559 IUPAC Name: methyl 3,5-di-tert-butylbenzoate SMILES: COC(=O)C1=CC(=CC(=C1)C(C)(C)C)C(C)(C)C
| PubChem CID | 13267559 |
|---|---|
| CAS | 64277-87-8 |
| Molecular Weight (g/mol) | 248.37 |
| MDL Number | MFCD03844786 |
| SMILES | COC(=O)C1=CC(=CC(=C1)C(C)(C)C)C(C)(C)C |
| Synonym | 3,5-Di-tert-butylbenzoic Acid Methyl Ester |
| IUPAC Name | methyl 3,5-di-tert-butylbenzoate |
| InChI Key | ZEIOQJMJXFVPOG-UHFFFAOYSA-N |
| Molecular Formula | C16H24O2 |
3-Formyl-2-methoxyphenylboronic Acid (contains varying amounts of Anhydride), TCI America™
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| Molecular Weight (g/mol) | 179.966 |
|---|---|
| Color | White-Yellow |
| Physical Form | Crystalline Powder |
| SMILES | B(C1=C(C(=CC=C1)C=O)OC)(O)O |
| InChI Key | DUROSIJIMLRFHR-UHFFFAOYSA-N |
| PubChem CID | 16218167 |
| CAS | 480424-49-5 |
| MDL Number | MFCD08689486 |
| TSCA | No |
| Recommended Storage | Refrigerator |
| IUPAC Name | (3-formyl-2-methoxyphenyl)boronic acid |
| Molecular Formula | C8H9BO4 |
| Formula Weight | 179.97 |
| Melting Point | 128°C |
4-Hexyloxyphenol 98.0+%, TCI America™
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CAS: 18979-55-0 Molecular Formula: C12H18O2 Molecular Weight (g/mol): 194.27 MDL Number: MFCD00002337 InChI Key: XIIIHRLCKLSYNH-UHFFFAOYSA-N Synonym: 4-hexyloxyphenol,4-hexyloxy phenol,phenol, 4-hexyloxy,4-n-hexyloxyphenol,p-hexyloxyphenol,unii-35ims9l1fe,35ims9l1fe,pubchem13208,acmc-1c6hg,hydroquinone monohexyl ether PubChem CID: 29354 ChEBI: CHEBI:34407 IUPAC Name: 4-(hexyloxy)phenol SMILES: CCCCCCOC1=CC=C(O)C=C1
| PubChem CID | 29354 |
|---|---|
| CAS | 18979-55-0 |
| Molecular Weight (g/mol) | 194.27 |
| ChEBI | CHEBI:34407 |
| MDL Number | MFCD00002337 |
| SMILES | CCCCCCOC1=CC=C(O)C=C1 |
| Synonym | 4-hexyloxyphenol,4-hexyloxy phenol,phenol, 4-hexyloxy,4-n-hexyloxyphenol,p-hexyloxyphenol,unii-35ims9l1fe,35ims9l1fe,pubchem13208,acmc-1c6hg,hydroquinone monohexyl ether |
| IUPAC Name | 4-(hexyloxy)phenol |
| InChI Key | XIIIHRLCKLSYNH-UHFFFAOYSA-N |
| Molecular Formula | C12H18O2 |
1'-Acetonaphthone 98.0+%, TCI America™
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CAS: 941-98-0 Molecular Formula: C12H10O Molecular Weight (g/mol): 170.211 MDL Number: MFCD00004013 InChI Key: QQLIGMASAVJVON-UHFFFAOYSA-N Synonym: 1'-acetonaphthone,1-acetonaphthone,1-acetylnaphthalene,methyl 1-naphthyl ketone,1-acetonaphthalene,1-1-naphthalenyl ethanone,ethanone, 1-1-naphthalenyl,1-naphthalen-1-yl ethanone,1-naphthyl methyl ketone,alpha-acetonaphthone PubChem CID: 13663 IUPAC Name: 1-naphthalen-1-ylethanone SMILES: CC(=O)C1=CC=CC2=CC=CC=C21
| PubChem CID | 13663 |
|---|---|
| CAS | 941-98-0 |
| Molecular Weight (g/mol) | 170.211 |
| MDL Number | MFCD00004013 |
| SMILES | CC(=O)C1=CC=CC2=CC=CC=C21 |
| Synonym | 1'-acetonaphthone,1-acetonaphthone,1-acetylnaphthalene,methyl 1-naphthyl ketone,1-acetonaphthalene,1-1-naphthalenyl ethanone,ethanone, 1-1-naphthalenyl,1-naphthalen-1-yl ethanone,1-naphthyl methyl ketone,alpha-acetonaphthone |
| IUPAC Name | 1-naphthalen-1-ylethanone |
| InChI Key | QQLIGMASAVJVON-UHFFFAOYSA-N |
| Molecular Formula | C12H10O |