Benzenoids
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1-(4-Methylphenoxy)-2-propanol 90.0+%, TCI America™
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CAS: 4369-08-8 Molecular Formula: C10H14O2 Molecular Weight (g/mol): 166.22 MDL Number: MFCD00191544 InChI Key: VTOVIJQMFYQNSX-UHFFFAOYNA-N Synonym: 1-(p-Tolyloxy)-2-propanol PubChem CID: 12384823 IUPAC Name: 1-(4-methylphenoxy)propan-2-ol SMILES: CC1=CC=C(C=C1)OCC(C)O
| PubChem CID | 12384823 |
|---|---|
| CAS | 4369-08-8 |
| Molecular Weight (g/mol) | 166.22 |
| MDL Number | MFCD00191544 |
| SMILES | CC1=CC=C(C=C1)OCC(C)O |
| Synonym | 1-(p-Tolyloxy)-2-propanol |
| IUPAC Name | 1-(4-methylphenoxy)propan-2-ol |
| InChI Key | VTOVIJQMFYQNSX-UHFFFAOYNA-N |
| Molecular Formula | C10H14O2 |
4-Nitrophenoxyacetic Acid 98.0+%, TCI America™
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CAS: 1798-11-4 Molecular Formula: C8H7NO5 Molecular Weight (g/mol): 197.146 MDL Number: MFCD00017030 InChI Key: AVDLFIONKHGQAP-UHFFFAOYSA-N Synonym: 4-nitrophenoxyacetic acid,2-4-nitrophenoxy acetic acid,4-nitrophenoxy acetic acid,p-nitrophenoxyacetic acid,acetic acid, 4-nitrophenoxy,4-nitro-phenoxy-acetic acid,acetic acid, p-nitrophenoxy,acetic acid, 2-4-nitrophenoxy,acmc-209efx PubChem CID: 15720 SMILES: C1=CC(=CC=C1[N+](=O)[O-])OCC(=O)O
| PubChem CID | 15720 |
|---|---|
| CAS | 1798-11-4 |
| Molecular Weight (g/mol) | 197.146 |
| MDL Number | MFCD00017030 |
| SMILES | C1=CC(=CC=C1[N+](=O)[O-])OCC(=O)O |
| Synonym | 4-nitrophenoxyacetic acid,2-4-nitrophenoxy acetic acid,4-nitrophenoxy acetic acid,p-nitrophenoxyacetic acid,acetic acid, 4-nitrophenoxy,4-nitro-phenoxy-acetic acid,acetic acid, p-nitrophenoxy,acetic acid, 2-4-nitrophenoxy,acmc-209efx |
| InChI Key | AVDLFIONKHGQAP-UHFFFAOYSA-N |
| Molecular Formula | C8H7NO5 |
Triphenylacetic Acid 97.0+%, TCI America™
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CAS: 595-91-5 Molecular Formula: C20H16O2 Molecular Weight (g/mol): 288.35 MDL Number: MFCD00004185 InChI Key: DCYGAPKNVCQNOE-UHFFFAOYSA-N Synonym: triphenylacetic acid,acetic acid, triphenyl,triphenyl acetic acid,benzeneacetic acid, .alpha.,.alpha.-diphenyl,nsc 61,tri phenylacetic acid,pubchem9200,alpha-toluic acid, alpha,alpha-diphenyl,acmc-1arvb,maybridge1_006927 PubChem CID: 68992 IUPAC Name: triphenylacetic acid SMILES: OC(=O)C(C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1
| PubChem CID | 68992 |
|---|---|
| CAS | 595-91-5 |
| Molecular Weight (g/mol) | 288.35 |
| MDL Number | MFCD00004185 |
| SMILES | OC(=O)C(C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1 |
| Synonym | triphenylacetic acid,acetic acid, triphenyl,triphenyl acetic acid,benzeneacetic acid, .alpha.,.alpha.-diphenyl,nsc 61,tri phenylacetic acid,pubchem9200,alpha-toluic acid, alpha,alpha-diphenyl,acmc-1arvb,maybridge1_006927 |
| IUPAC Name | triphenylacetic acid |
| InChI Key | DCYGAPKNVCQNOE-UHFFFAOYSA-N |
| Molecular Formula | C20H16O2 |
2-Ethylhexyl 2-Cyano-3,3-diphenylacrylate 98.0+%, TCI America™
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CAS: 6197-30-4 Molecular Formula: C24H27NO2 Molecular Weight (g/mol): 361.49 MDL Number: MFCD00059260 InChI Key: FMJSMJQBSVNSBF-UHFFFAOYNA-N Synonym: 2-Cyano-3,3-diphenylacrylic Acid 2-Ethylhexyl Ester, Octyl 2-Cyano-3,3-diphenylacrylate PubChem CID: 22571 IUPAC Name: 2-ethylhexyl 2-cyano-3,3-diphenylprop-2-enoate SMILES: CCCCC(CC)COC(=O)C(C#N)=C(C1=CC=CC=C1)C1=CC=CC=C1
| PubChem CID | 22571 |
|---|---|
| CAS | 6197-30-4 |
| Molecular Weight (g/mol) | 361.49 |
| MDL Number | MFCD00059260 |
| SMILES | CCCCC(CC)COC(=O)C(C#N)=C(C1=CC=CC=C1)C1=CC=CC=C1 |
| Synonym | 2-Cyano-3,3-diphenylacrylic Acid 2-Ethylhexyl Ester, Octyl 2-Cyano-3,3-diphenylacrylate |
| IUPAC Name | 2-ethylhexyl 2-cyano-3,3-diphenylprop-2-enoate |
| InChI Key | FMJSMJQBSVNSBF-UHFFFAOYNA-N |
| Molecular Formula | C24H27NO2 |
(4-Allyl-2-methoxyphenoxy)acetic Acid 98.0+%, TCI America™
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CAS: 6331-61-9 Molecular Formula: C12H14O4 Molecular Weight (g/mol): 222.24 MDL Number: MFCD00017594 InChI Key: FQBPCNCFOCPCJP-UHFFFAOYSA-N PubChem CID: 235909 IUPAC Name: 2-(2-methoxy-4-prop-2-enylphenoxy)acetic acid SMILES: COC1=C(C=CC(=C1)CC=C)OCC(=O)O
| PubChem CID | 235909 |
|---|---|
| CAS | 6331-61-9 |
| Molecular Weight (g/mol) | 222.24 |
| MDL Number | MFCD00017594 |
| SMILES | COC1=C(C=CC(=C1)CC=C)OCC(=O)O |
| IUPAC Name | 2-(2-methoxy-4-prop-2-enylphenoxy)acetic acid |
| InChI Key | FQBPCNCFOCPCJP-UHFFFAOYSA-N |
| Molecular Formula | C12H14O4 |
2-(Chloromethyl)benzoyl Chloride 98.0+%, TCI America™
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CAS: 42908-86-1 Molecular Formula: C8H6Cl2O Molecular Weight (g/mol): 189.04 MDL Number: MFCD00152348 InChI Key: TXZFBHYDQGYOIT-UHFFFAOYSA-N PubChem CID: 3016395 IUPAC Name: 2-(chloromethyl)benzoyl chloride SMILES: ClCC1=CC=CC=C1C(Cl)=O
| PubChem CID | 3016395 |
|---|---|
| CAS | 42908-86-1 |
| Molecular Weight (g/mol) | 189.04 |
| MDL Number | MFCD00152348 |
| SMILES | ClCC1=CC=CC=C1C(Cl)=O |
| IUPAC Name | 2-(chloromethyl)benzoyl chloride |
| InChI Key | TXZFBHYDQGYOIT-UHFFFAOYSA-N |
| Molecular Formula | C8H6Cl2O |
(3-Chlorophenyl)thiourea 98.0+%, TCI America™
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CAS: 4947-89-1 Molecular Formula: C7H7ClN2S Molecular Weight (g/mol): 186.657 MDL Number: MFCD00022165 InChI Key: LSYZRUOXXOTVAV-UHFFFAOYSA-N Synonym: 1-3-chlorophenyl thiourea,3-chlorophenyl thiourea,n-3-chlorophenyl thiourea,m-chlorophenyl thiourea,thiourea, 3-chlorophenyl,1-m-chlorophenyl thiourea,urea, 1-m-chlorophenyl-2-thio,1-3-chlorophenyl-2-thiourea PubChem CID: 2734794 IUPAC Name: (3-chlorophenyl)thiourea SMILES: C1=CC(=CC(=C1)Cl)NC(=S)N
| PubChem CID | 2734794 |
|---|---|
| CAS | 4947-89-1 |
| Molecular Weight (g/mol) | 186.657 |
| MDL Number | MFCD00022165 |
| SMILES | C1=CC(=CC(=C1)Cl)NC(=S)N |
| Synonym | 1-3-chlorophenyl thiourea,3-chlorophenyl thiourea,n-3-chlorophenyl thiourea,m-chlorophenyl thiourea,thiourea, 3-chlorophenyl,1-m-chlorophenyl thiourea,urea, 1-m-chlorophenyl-2-thio,1-3-chlorophenyl-2-thiourea |
| IUPAC Name | (3-chlorophenyl)thiourea |
| InChI Key | LSYZRUOXXOTVAV-UHFFFAOYSA-N |
| Molecular Formula | C7H7ClN2S |
4-Bromoresorcinol 98.0+%, TCI America™
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CAS: 6626-15-9 Molecular Formula: C6H5BrO2 Molecular Weight (g/mol): 189.008 MDL Number: MFCD00002272 InChI Key: MPCCNXGZCOXPMG-UHFFFAOYSA-N Synonym: 4-bromoresorcinol,1-bromo-2,4-dihydroxybenzene,1,3-benzenediol, 4-bromo,4-bromo-1,3-dihydroxybenzene,4-bromo-benzene-1,3-diol,4-bromo-resorcinol,resorcinol, 4-bromo,acmc-209nuf,2,4-dihydroxybromobenzene PubChem CID: 81105 IUPAC Name: 4-bromobenzene-1,3-diol SMILES: C1=CC(=C(C=C1O)O)Br
| PubChem CID | 81105 |
|---|---|
| CAS | 6626-15-9 |
| Molecular Weight (g/mol) | 189.008 |
| MDL Number | MFCD00002272 |
| SMILES | C1=CC(=C(C=C1O)O)Br |
| Synonym | 4-bromoresorcinol,1-bromo-2,4-dihydroxybenzene,1,3-benzenediol, 4-bromo,4-bromo-1,3-dihydroxybenzene,4-bromo-benzene-1,3-diol,4-bromo-resorcinol,resorcinol, 4-bromo,acmc-209nuf,2,4-dihydroxybromobenzene |
| IUPAC Name | 4-bromobenzene-1,3-diol |
| InChI Key | MPCCNXGZCOXPMG-UHFFFAOYSA-N |
| Molecular Formula | C6H5BrO2 |
1,1'-Bi-2-naphthol 99.0+%, TCI America™
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CAS: 602-09-5 Molecular Formula: C20H14O2 Molecular Weight (g/mol): 286.33 MDL Number: MFCD00004068 InChI Key: PPTXVXKCQZKFBN-UHFFFAOYSA-N Synonym: 1,1'-bi-2-naphthol,s---1,1'-bi-2-naphthol,r-+-1,1'-bi-2-naphthol,1,1'-binaphthalene-2,2'-diol,binol,1,1'-binaphthyl-2,2'-diol,2,2'-dinaphthol,beta-binaphthol,r-1,1'-bi-2-naphthol,s-1,1'-binaphthalene-2,2'-diol PubChem CID: 11762 IUPAC Name: 1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol SMILES: C1=CC=C2C(=C1)C=CC(=C2C3=C(C=CC4=CC=CC=C43)O)O
| PubChem CID | 11762 |
|---|---|
| CAS | 602-09-5 |
| Molecular Weight (g/mol) | 286.33 |
| MDL Number | MFCD00004068 |
| SMILES | C1=CC=C2C(=C1)C=CC(=C2C3=C(C=CC4=CC=CC=C43)O)O |
| Synonym | 1,1'-bi-2-naphthol,s---1,1'-bi-2-naphthol,r-+-1,1'-bi-2-naphthol,1,1'-binaphthalene-2,2'-diol,binol,1,1'-binaphthyl-2,2'-diol,2,2'-dinaphthol,beta-binaphthol,r-1,1'-bi-2-naphthol,s-1,1'-binaphthalene-2,2'-diol |
| IUPAC Name | 1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol |
| InChI Key | PPTXVXKCQZKFBN-UHFFFAOYSA-N |
| Molecular Formula | C20H14O2 |
4,4'-Biphenyldicarbonitrile 97.0+%, TCI America™
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CAS: 1591-30-6 Molecular Formula: C14H8N2 Molecular Weight (g/mol): 204.232 MDL Number: MFCD00013805 InChI Key: KAXYYLCSSXFXKR-UHFFFAOYSA-N Synonym: 4,4'-biphenyldicarbonitrile,1,1'-biphenyl-4,4'-dicarbonitrile,4,4'-dicyanobiphenyl,biphenyl-4,4'-dicarbonitrile,4,4'-dicyanodiphenyl,4,4'-diphenyldicarbonitrile,4-4-cyanophenyl benzonitrile,4-4-cyanophenyl benzenecarbonitrile PubChem CID: 15321 IUPAC Name: 4-(4-cyanophenyl)benzonitrile SMILES: C1=CC(=CC=C1C#N)C2=CC=C(C=C2)C#N
| PubChem CID | 15321 |
|---|---|
| CAS | 1591-30-6 |
| Molecular Weight (g/mol) | 204.232 |
| MDL Number | MFCD00013805 |
| SMILES | C1=CC(=CC=C1C#N)C2=CC=C(C=C2)C#N |
| Synonym | 4,4'-biphenyldicarbonitrile,1,1'-biphenyl-4,4'-dicarbonitrile,4,4'-dicyanobiphenyl,biphenyl-4,4'-dicarbonitrile,4,4'-dicyanodiphenyl,4,4'-diphenyldicarbonitrile,4-4-cyanophenyl benzonitrile,4-4-cyanophenyl benzenecarbonitrile |
| IUPAC Name | 4-(4-cyanophenyl)benzonitrile |
| InChI Key | KAXYYLCSSXFXKR-UHFFFAOYSA-N |
| Molecular Formula | C14H8N2 |
2-Bromo-5-methoxybenzoic Acid 98.0+%, TCI America™
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CAS: 22921-68-2 Molecular Formula: C8H7BrO3 Molecular Weight (g/mol): 231.045 MDL Number: MFCD00020214 InChI Key: ODHJOROUCITYNF-UHFFFAOYSA-N Synonym: 6-bromo-m-anisic acid,2-bromo-5-methoxybenzoicacid,benzoic acid, 2-bromo-5-methoxy,5-methoxy-2-bromobenzoic acid,2-bromo-5-methoxy-benzoic acid,pubchem2674,acmc-1clk6,ksc205k0l,rarechem al be 1111,2-bromo-5-methoxy benzoic acid PubChem CID: 89906 IUPAC Name: 2-bromo-5-methoxybenzoic acid SMILES: COC1=CC(=C(C=C1)Br)C(=O)O
| PubChem CID | 89906 |
|---|---|
| CAS | 22921-68-2 |
| Molecular Weight (g/mol) | 231.045 |
| MDL Number | MFCD00020214 |
| SMILES | COC1=CC(=C(C=C1)Br)C(=O)O |
| Synonym | 6-bromo-m-anisic acid,2-bromo-5-methoxybenzoicacid,benzoic acid, 2-bromo-5-methoxy,5-methoxy-2-bromobenzoic acid,2-bromo-5-methoxy-benzoic acid,pubchem2674,acmc-1clk6,ksc205k0l,rarechem al be 1111,2-bromo-5-methoxy benzoic acid |
| IUPAC Name | 2-bromo-5-methoxybenzoic acid |
| InChI Key | ODHJOROUCITYNF-UHFFFAOYSA-N |
| Molecular Formula | C8H7BrO3 |
3-Bromo-4-chlorobenzoic Acid 98.0+%, TCI America™
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CAS: 42860-10-6 Molecular Formula: C7H4BrClO2 Molecular Weight (g/mol): 235.46 MDL Number: MFCD00079706 InChI Key: NLEPZGNUPNMRGF-UHFFFAOYSA-N Synonym: 3-bromo-4-chloro-benzoic acid,benzoic acid, 3-bromo-4-chloro,4-chloro-3-bromobenzoic acid,pubchem3585,acmc-1cufe,3-bromo-4-chlorobenzoicacid,ksc235m9l,timtec-bb sbb017622,zerenex e/9071912 PubChem CID: 2735544 IUPAC Name: 3-bromo-4-chlorobenzoic acid SMILES: OC(=O)C1=CC(Br)=C(Cl)C=C1
| PubChem CID | 2735544 |
|---|---|
| CAS | 42860-10-6 |
| Molecular Weight (g/mol) | 235.46 |
| MDL Number | MFCD00079706 |
| SMILES | OC(=O)C1=CC(Br)=C(Cl)C=C1 |
| Synonym | 3-bromo-4-chloro-benzoic acid,benzoic acid, 3-bromo-4-chloro,4-chloro-3-bromobenzoic acid,pubchem3585,acmc-1cufe,3-bromo-4-chlorobenzoicacid,ksc235m9l,timtec-bb sbb017622,zerenex e/9071912 |
| IUPAC Name | 3-bromo-4-chlorobenzoic acid |
| InChI Key | NLEPZGNUPNMRGF-UHFFFAOYSA-N |
| Molecular Formula | C7H4BrClO2 |
2-Bromo-4-fluoroanisole 98.0+%, TCI America™
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CAS: 452-08-4 Molecular Formula: C7H6BrFO Molecular Weight (g/mol): 205.03 MDL Number: MFCD00012014 InChI Key: JIQXVIJARQLCOY-UHFFFAOYSA-N Synonym: 2-bromo-4-fluoroanisole,benzene, 2-bromo-4-fluoro-1-methoxy,2-bromo-4-fluoro anisole,1-bromo-3-fluoro-6-methoxybenzene,2-bromo-4-fluoro-methoxybenzene,2-bromo-4-fluoro-1-methoxy-benzene,1-bromo-5-fluoro-2-methoxybenzene,attercop-chm at106665,pubchem1972,2-bromo-4-fluoroanisol PubChem CID: 136292 IUPAC Name: 2-bromo-4-fluoro-1-methoxybenzene SMILES: COC1=CC=C(F)C=C1Br
| PubChem CID | 136292 |
|---|---|
| CAS | 452-08-4 |
| Molecular Weight (g/mol) | 205.03 |
| MDL Number | MFCD00012014 |
| SMILES | COC1=CC=C(F)C=C1Br |
| Synonym | 2-bromo-4-fluoroanisole,benzene, 2-bromo-4-fluoro-1-methoxy,2-bromo-4-fluoro anisole,1-bromo-3-fluoro-6-methoxybenzene,2-bromo-4-fluoro-methoxybenzene,2-bromo-4-fluoro-1-methoxy-benzene,1-bromo-5-fluoro-2-methoxybenzene,attercop-chm at106665,pubchem1972,2-bromo-4-fluoroanisol |
| IUPAC Name | 2-bromo-4-fluoro-1-methoxybenzene |
| InChI Key | JIQXVIJARQLCOY-UHFFFAOYSA-N |
| Molecular Formula | C7H6BrFO |
2-Bromo-5-methoxytoluene 97.0+%, TCI America™
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CAS: 27060-75-9 Molecular Formula: C8H9BrO Molecular Weight (g/mol): 201.063 MDL Number: MFCD00060687 InChI Key: BLZNSXFQRKVFRP-UHFFFAOYSA-N Synonym: 2-bromo-5-methoxytoluene,4-bromo-3-methylanisole,benzene, 1-bromo-4-methoxy-2-methyl,4-bromo-3-methyl-anisole,unii-okr329132j,1-bromo-2-methyl-4-methoxybenzene,1-brom-4-methoxy-2-methylbenzol,pubchem3796,3-methyl-4-bromoanisole,acmc-1cg4z PubChem CID: 117915 IUPAC Name: 1-bromo-4-methoxy-2-methylbenzene SMILES: CC1=C(C=CC(=C1)OC)Br
| PubChem CID | 117915 |
|---|---|
| CAS | 27060-75-9 |
| Molecular Weight (g/mol) | 201.063 |
| MDL Number | MFCD00060687 |
| SMILES | CC1=C(C=CC(=C1)OC)Br |
| Synonym | 2-bromo-5-methoxytoluene,4-bromo-3-methylanisole,benzene, 1-bromo-4-methoxy-2-methyl,4-bromo-3-methyl-anisole,unii-okr329132j,1-bromo-2-methyl-4-methoxybenzene,1-brom-4-methoxy-2-methylbenzol,pubchem3796,3-methyl-4-bromoanisole,acmc-1cg4z |
| IUPAC Name | 1-bromo-4-methoxy-2-methylbenzene |
| InChI Key | BLZNSXFQRKVFRP-UHFFFAOYSA-N |
| Molecular Formula | C8H9BrO |
3-Bromo-5-fluorophenol 98.0+%, TCI America™
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CAS: 433939-27-6 Molecular Formula: C6H4BrFO Molecular Weight (g/mol): 190.999 MDL Number: MFCD07783710 InChI Key: JCPJGUPQZDEZQH-UHFFFAOYSA-N Synonym: 3-fluoro-5-bromophenol,5-bromo-3-fluorophenol,3-bromo-5-fluoro-phenol,phenol, 3-bromo-5-fluoro,pubchem4129,acmc-1apwb,ksc493m6t,3-bromo-5-fluorophenol PubChem CID: 21904636 IUPAC Name: 3-bromo-5-fluorophenol SMILES: C1=C(C=C(C=C1F)Br)O
| PubChem CID | 21904636 |
|---|---|
| CAS | 433939-27-6 |
| Molecular Weight (g/mol) | 190.999 |
| MDL Number | MFCD07783710 |
| SMILES | C1=C(C=C(C=C1F)Br)O |
| Synonym | 3-fluoro-5-bromophenol,5-bromo-3-fluorophenol,3-bromo-5-fluoro-phenol,phenol, 3-bromo-5-fluoro,pubchem4129,acmc-1apwb,ksc493m6t,3-bromo-5-fluorophenol |
| IUPAC Name | 3-bromo-5-fluorophenol |
| InChI Key | JCPJGUPQZDEZQH-UHFFFAOYSA-N |
| Molecular Formula | C6H4BrFO |