Benzenoids
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5-(4-Fluorophenoxy)valeric Acid 98.0+%, TCI America™
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CAS: 347867-75-8 Molecular Formula: C11H13FO3 Molecular Weight (g/mol): 212.22 MDL Number: MFCD02093469 InChI Key: SNUHBWJBUYDESY-UHFFFAOYSA-N PubChem CID: 22556441 IUPAC Name: 5-(4-fluorophenoxy)pentanoic acid SMILES: C1=CC(=CC=C1OCCCCC(=O)O)F
| PubChem CID | 22556441 |
|---|---|
| CAS | 347867-75-8 |
| Molecular Weight (g/mol) | 212.22 |
| MDL Number | MFCD02093469 |
| SMILES | C1=CC(=CC=C1OCCCCC(=O)O)F |
| IUPAC Name | 5-(4-fluorophenoxy)pentanoic acid |
| InChI Key | SNUHBWJBUYDESY-UHFFFAOYSA-N |
| Molecular Formula | C11H13FO3 |
4-Formyl-trans-stilbene 98.0+%, TCI America™
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CAS: 40200-69-9 Molecular Formula: C15H12O Molecular Weight (g/mol): 208.26 MDL Number: MFCD00011580 InChI Key: CLXSBHRRZNBTRT-VOTSOKGWSA-N Synonym: trans-4-Stilbenecarboxaldehyde PubChem CID: 5375876 IUPAC Name: 4-[(E)-2-phenylethenyl]benzaldehyde SMILES: C1=CC=C(C=C1)C=CC2=CC=C(C=C2)C=O
| PubChem CID | 5375876 |
|---|---|
| CAS | 40200-69-9 |
| Molecular Weight (g/mol) | 208.26 |
| MDL Number | MFCD00011580 |
| SMILES | C1=CC=C(C=C1)C=CC2=CC=C(C=C2)C=O |
| Synonym | trans-4-Stilbenecarboxaldehyde |
| IUPAC Name | 4-[(E)-2-phenylethenyl]benzaldehyde |
| InChI Key | CLXSBHRRZNBTRT-VOTSOKGWSA-N |
| Molecular Formula | C15H12O |
S-p-Tolyl p-Toluenesulfonothioate 98.0+%, TCI America™
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CAS: 2943-42-2 Molecular Formula: C14H14O2S2 Molecular Weight (g/mol): 278.38 MDL Number: MFCD00092126 InChI Key: HSAROCRPZOYKGS-UHFFFAOYSA-N Synonym: p-Toluenesulfonothioic Acid S-p-Tolyl Ester PubChem CID: 257647 IUPAC Name: 1-methyl-4-[(4-methylbenzenesulfonyl)sulfanyl]benzene SMILES: CC1=CC=C(SS(=O)(=O)C2=CC=C(C)C=C2)C=C1
| PubChem CID | 257647 |
|---|---|
| CAS | 2943-42-2 |
| Molecular Weight (g/mol) | 278.38 |
| MDL Number | MFCD00092126 |
| SMILES | CC1=CC=C(SS(=O)(=O)C2=CC=C(C)C=C2)C=C1 |
| Synonym | p-Toluenesulfonothioic Acid S-p-Tolyl Ester |
| IUPAC Name | 1-methyl-4-[(4-methylbenzenesulfonyl)sulfanyl]benzene |
| InChI Key | HSAROCRPZOYKGS-UHFFFAOYSA-N |
| Molecular Formula | C14H14O2S2 |
4-Aminophthalic Acid 95.0+%, TCI America™
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CAS: 5434-21-9 Molecular Formula: C8H7NO4 Molecular Weight (g/mol): 181.147 MDL Number: MFCD00013985 InChI Key: OXSANYRLJHSQEP-UHFFFAOYSA-N Synonym: 4-aminobenzene-1,2-dicarboxylic acid,1,2-benzenedicarboxylic acid, 4-amino,4-amino-1,2-benzenedicarboxylic acid,4-amino phthalic acid,contains 3-aminophthalic acid,pubchem16853,acmc-1arqu,4-aminophthalic acid,ksc270i4n,ghl.pd_mitscher_leg0.1208 PubChem CID: 72912 IUPAC Name: 4-aminophthalic acid SMILES: C1=CC(=C(C=C1N)C(=O)O)C(=O)O
| PubChem CID | 72912 |
|---|---|
| CAS | 5434-21-9 |
| Molecular Weight (g/mol) | 181.147 |
| MDL Number | MFCD00013985 |
| SMILES | C1=CC(=C(C=C1N)C(=O)O)C(=O)O |
| Synonym | 4-aminobenzene-1,2-dicarboxylic acid,1,2-benzenedicarboxylic acid, 4-amino,4-amino-1,2-benzenedicarboxylic acid,4-amino phthalic acid,contains 3-aminophthalic acid,pubchem16853,acmc-1arqu,4-aminophthalic acid,ksc270i4n,ghl.pd_mitscher_leg0.1208 |
| IUPAC Name | 4-aminophthalic acid |
| InChI Key | OXSANYRLJHSQEP-UHFFFAOYSA-N |
| Molecular Formula | C8H7NO4 |
1-Bromo-4-dodecylbenzene 95.0+%, TCI America™
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CAS: 126930-72-1 Molecular Formula: C18H29Br Molecular Weight (g/mol): 325.334 MDL Number: MFCD00191386 InChI Key: RFFMRBISTZHCNY-UHFFFAOYSA-N Synonym: 4-dodecylbromobenzene,1-bromo-4-n-dodecylbenzene,benzene, 1-bromo-4-dodecyl,4-bromododecylbenzene,pubchem22735,acmc-209bby,1-bromo-4-dodecyl-benzene,ksc494g6d,4-n-dodecylbromobenzene PubChem CID: 15120506 IUPAC Name: 1-bromo-4-dodecylbenzene SMILES: CCCCCCCCCCCCC1=CC=C(C=C1)Br
| PubChem CID | 15120506 |
|---|---|
| CAS | 126930-72-1 |
| Molecular Weight (g/mol) | 325.334 |
| MDL Number | MFCD00191386 |
| SMILES | CCCCCCCCCCCCC1=CC=C(C=C1)Br |
| Synonym | 4-dodecylbromobenzene,1-bromo-4-n-dodecylbenzene,benzene, 1-bromo-4-dodecyl,4-bromododecylbenzene,pubchem22735,acmc-209bby,1-bromo-4-dodecyl-benzene,ksc494g6d,4-n-dodecylbromobenzene |
| IUPAC Name | 1-bromo-4-dodecylbenzene |
| InChI Key | RFFMRBISTZHCNY-UHFFFAOYSA-N |
| Molecular Formula | C18H29Br |
(3S)-(+)-1-Benzyl-3-(methylamino)pyrrolidine 98.0+%, TCI America™
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CAS: 169749-99-9 Molecular Formula: C12H18N2 Molecular Weight (g/mol): 190.29 MDL Number: MFCD00191310 InChI Key: UEAYAIWNQQWSBK-LBPRGKRZSA-N PubChem CID: 10397666 IUPAC Name: (3S)-1-benzyl-N-methylpyrrolidin-3-amine SMILES: CNC1CCN(C1)CC2=CC=CC=C2
| PubChem CID | 10397666 |
|---|---|
| CAS | 169749-99-9 |
| Molecular Weight (g/mol) | 190.29 |
| MDL Number | MFCD00191310 |
| SMILES | CNC1CCN(C1)CC2=CC=CC=C2 |
| IUPAC Name | (3S)-1-benzyl-N-methylpyrrolidin-3-amine |
| InChI Key | UEAYAIWNQQWSBK-LBPRGKRZSA-N |
| Molecular Formula | C12H18N2 |
2,6-Dichlorophenol 99.0+%, TCI America™
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CAS: 87-65-0 Molecular Formula: C6H4Cl2O Molecular Weight (g/mol): 163.00 MDL Number: MFCD00002176 InChI Key: HOLHYSJJBXSLMV-UHFFFAOYSA-N Synonym: phenol, 2,6-dichloro,2,6-dichlorfenol,2,6-dichlorphenol,rcra waste number u082,2,6-dichloro-phenol,2,6-dichlorfenol czech,unii-q7e9k52w7e,2,6 dichlorophenol,ccris 2511,2,6-dcp PubChem CID: 6899 ChEBI: CHEBI:28457 IUPAC Name: 2,6-dichlorophenol SMILES: OC1=C(Cl)C=CC=C1Cl
| PubChem CID | 6899 |
|---|---|
| CAS | 87-65-0 |
| Molecular Weight (g/mol) | 163.00 |
| ChEBI | CHEBI:28457 |
| MDL Number | MFCD00002176 |
| SMILES | OC1=C(Cl)C=CC=C1Cl |
| Synonym | phenol, 2,6-dichloro,2,6-dichlorfenol,2,6-dichlorphenol,rcra waste number u082,2,6-dichloro-phenol,2,6-dichlorfenol czech,unii-q7e9k52w7e,2,6 dichlorophenol,ccris 2511,2,6-dcp |
| IUPAC Name | 2,6-dichlorophenol |
| InChI Key | HOLHYSJJBXSLMV-UHFFFAOYSA-N |
| Molecular Formula | C6H4Cl2O |
1-(2,4,6-Triisopropylbenzenesulfonyl)imidazole 98.0+%, TCI America™
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CAS: 50257-40-4 Molecular Formula: C18H26N2O2S Molecular Weight (g/mol): 334.478 MDL Number: MFCD00005283 InChI Key: AGGRGODMKWLSDE-UHFFFAOYSA-N Synonym: 1-2,4,6-triisopropylphenyl sulfonyl-1h-imidazole,1-2,4,6-triisopropylbenzenesulfonyl imidazole,1-2,4,6-triisopropylphenylsulfonyl imidazole,tpsi,1-2',4',6'-triisopropylbenzenesulphonyl imidazole,1-2,4,6-tri propan-2-yl phenyl sulfonylimidazole,tpsi 1-2,4,6-triisopropylbenzenesulfonyl imidazole,1h-imidazole, 1-2,4,6-tris 1-methylethyl phenyl sulfonyl,1-2,4,6-trisopropylbenzenesulfonyl imidazole PubChem CID: 521274 IUPAC Name: 1-[2,4,6-tri(propan-2-yl)phenyl]sulfonylimidazole SMILES: CC(C)C1=CC(=C(C(=C1)C(C)C)S(=O)(=O)N2C=CN=C2)C(C)C
| PubChem CID | 521274 |
|---|---|
| CAS | 50257-40-4 |
| Molecular Weight (g/mol) | 334.478 |
| MDL Number | MFCD00005283 |
| SMILES | CC(C)C1=CC(=C(C(=C1)C(C)C)S(=O)(=O)N2C=CN=C2)C(C)C |
| Synonym | 1-2,4,6-triisopropylphenyl sulfonyl-1h-imidazole,1-2,4,6-triisopropylbenzenesulfonyl imidazole,1-2,4,6-triisopropylphenylsulfonyl imidazole,tpsi,1-2',4',6'-triisopropylbenzenesulphonyl imidazole,1-2,4,6-tri propan-2-yl phenyl sulfonylimidazole,tpsi 1-2,4,6-triisopropylbenzenesulfonyl imidazole,1h-imidazole, 1-2,4,6-tris 1-methylethyl phenyl sulfonyl,1-2,4,6-trisopropylbenzenesulfonyl imidazole |
| IUPAC Name | 1-[2,4,6-tri(propan-2-yl)phenyl]sulfonylimidazole |
| InChI Key | AGGRGODMKWLSDE-UHFFFAOYSA-N |
| Molecular Formula | C18H26N2O2S |
2-Hydroxybenzotrifluoride 98.0+%, TCI America™
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CAS: 444-30-4 Molecular Formula: C7H5F3O Molecular Weight (g/mol): 162.111 MDL Number: MFCD00002222 InChI Key: ZOQOPXVJANRGJZ-UHFFFAOYSA-N Synonym: 2-trifluoromethyl phenol,2-hydroxybenzotrifluoride,o-trifluoromethylphenol,o-hydroxybenzotrifluoride,alpha,alpha,alpha-trifluoro-o-cresol,phenol, 2-trifluoromethyl,o-trifluoromethoxy phenol,a,a,a-trifluoro-o-cresol,2-hydroxy-alpha,alpha,alpha-trifluorotoluene PubChem CID: 67958 IUPAC Name: 2-(trifluoromethyl)phenol SMILES: C1=CC=C(C(=C1)C(F)(F)F)O
| PubChem CID | 67958 |
|---|---|
| CAS | 444-30-4 |
| Molecular Weight (g/mol) | 162.111 |
| MDL Number | MFCD00002222 |
| SMILES | C1=CC=C(C(=C1)C(F)(F)F)O |
| Synonym | 2-trifluoromethyl phenol,2-hydroxybenzotrifluoride,o-trifluoromethylphenol,o-hydroxybenzotrifluoride,alpha,alpha,alpha-trifluoro-o-cresol,phenol, 2-trifluoromethyl,o-trifluoromethoxy phenol,a,a,a-trifluoro-o-cresol,2-hydroxy-alpha,alpha,alpha-trifluorotoluene |
| IUPAC Name | 2-(trifluoromethyl)phenol |
| InChI Key | ZOQOPXVJANRGJZ-UHFFFAOYSA-N |
| Molecular Formula | C7H5F3O |
Liranaftate 98.0+%, TCI America™
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CAS: 88678-31-3 Molecular Formula: C18H20N2O2S Molecular Weight (g/mol): 328.43 MDL Number: MFCD00865576 InChI Key: VPHPQNGOVQYUMG-UHFFFAOYSA-N Synonym: O-(5,6,7,8-Tetrahydronaphthalen-2-yl) (6-Methoxypyridin-2-yl)(methyl)carbamothioate, (6-Methoxypyridin-2-yl)(methyl)carbamothioic Acid O-(5,6,7,8-Tetrahydronaphthalen-2-yl) Ester PubChem CID: 3936 IUPAC Name: N-(6-methoxypyridin-2-yl)-N-methyl-1-(5,6,7,8-tetrahydronaphthalen-2-yloxy)methanethioamide SMILES: COC1=CC=CC(=N1)N(C)C(=S)OC1=CC=C2CCCCC2=C1
| PubChem CID | 3936 |
|---|---|
| CAS | 88678-31-3 |
| Molecular Weight (g/mol) | 328.43 |
| MDL Number | MFCD00865576 |
| SMILES | COC1=CC=CC(=N1)N(C)C(=S)OC1=CC=C2CCCCC2=C1 |
| Synonym | O-(5,6,7,8-Tetrahydronaphthalen-2-yl) (6-Methoxypyridin-2-yl)(methyl)carbamothioate, (6-Methoxypyridin-2-yl)(methyl)carbamothioic Acid O-(5,6,7,8-Tetrahydronaphthalen-2-yl) Ester |
| IUPAC Name | N-(6-methoxypyridin-2-yl)-N-methyl-1-(5,6,7,8-tetrahydronaphthalen-2-yloxy)methanethioamide |
| InChI Key | VPHPQNGOVQYUMG-UHFFFAOYSA-N |
| Molecular Formula | C18H20N2O2S |
Dimethyl 2,3-Naphthalenedicarboxylate 97.0+%, TCI America™
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CAS: 13728-34-2 Molecular Formula: C14H12O4 Molecular Weight (g/mol): 244.246 MDL Number: MFCD00012278 InChI Key: MPDGBCOIHNLQMR-UHFFFAOYSA-N Synonym: 2,3-Naphthalenedicarboxylic Acid Dimethyl Ester PubChem CID: 688113 IUPAC Name: dimethyl naphthalene-2,3-dicarboxylate SMILES: COC(=O)C1=CC2=CC=CC=C2C=C1C(=O)OC
| PubChem CID | 688113 |
|---|---|
| CAS | 13728-34-2 |
| Molecular Weight (g/mol) | 244.246 |
| MDL Number | MFCD00012278 |
| SMILES | COC(=O)C1=CC2=CC=CC=C2C=C1C(=O)OC |
| Synonym | 2,3-Naphthalenedicarboxylic Acid Dimethyl Ester |
| IUPAC Name | dimethyl naphthalene-2,3-dicarboxylate |
| InChI Key | MPDGBCOIHNLQMR-UHFFFAOYSA-N |
| Molecular Formula | C14H12O4 |
3,4-Dimethylphenol 98.0+%, TCI America™
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CAS: 95-65-8 Molecular Formula: C8H10O Molecular Weight (g/mol): 122.17 MDL Number: MFCD00002304 InChI Key: YCOXTKKNXUZSKD-UHFFFAOYSA-N Synonym: 3,4-xylenol,phenol, 3,4-dimethyl,4,5-dimethylphenol,3,4-dimethyl phenol,1,3,4-xylenol,4-hydroxy-1,2-dimethylbenzene,1-hydroxy-3,4-dimethylbenzene,3,4-dimethyl-phenol,3,4-dmp,ccris 723 PubChem CID: 7249 ChEBI: CHEBI:39839 IUPAC Name: 3,4-dimethylphenol SMILES: CC1=CC=C(O)C=C1C
| PubChem CID | 7249 |
|---|---|
| CAS | 95-65-8 |
| Molecular Weight (g/mol) | 122.17 |
| ChEBI | CHEBI:39839 |
| MDL Number | MFCD00002304 |
| SMILES | CC1=CC=C(O)C=C1C |
| Synonym | 3,4-xylenol,phenol, 3,4-dimethyl,4,5-dimethylphenol,3,4-dimethyl phenol,1,3,4-xylenol,4-hydroxy-1,2-dimethylbenzene,1-hydroxy-3,4-dimethylbenzene,3,4-dimethyl-phenol,3,4-dmp,ccris 723 |
| IUPAC Name | 3,4-dimethylphenol |
| InChI Key | YCOXTKKNXUZSKD-UHFFFAOYSA-N |
| Molecular Formula | C8H10O |
4-Methyl-3-(trifluoromethyl)aniline 98.0+%, TCI America™
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CAS: 65934-74-9 Molecular Formula: C8H8F3N Molecular Weight (g/mol): 175.154 MDL Number: MFCD01631582 InChI Key: JBCDCYFEJQHTTA-UHFFFAOYSA-N Synonym: 4-methyl-3-trifluoromethyl aniline,5-amino-2-methylbenzotrifluoride,3-trifluoromethyl-4-methylaniline,benzenamine, 4-methyl-3-trifluoromethyl,4-methyl-5-trifluoromethyl aniline,4-methyl-3-trifluoromethyl-phenylamine,4-methyl-5-trifluoromethylaniline,3-trifluoromethyl-p-toluidine,4-methyl-3-trifluoromethyl phenylamine PubChem CID: 2737715 IUPAC Name: 4-methyl-3-(trifluoromethyl)aniline SMILES: CC1=C(C=C(C=C1)N)C(F)(F)F
| PubChem CID | 2737715 |
|---|---|
| CAS | 65934-74-9 |
| Molecular Weight (g/mol) | 175.154 |
| MDL Number | MFCD01631582 |
| SMILES | CC1=C(C=C(C=C1)N)C(F)(F)F |
| Synonym | 4-methyl-3-trifluoromethyl aniline,5-amino-2-methylbenzotrifluoride,3-trifluoromethyl-4-methylaniline,benzenamine, 4-methyl-3-trifluoromethyl,4-methyl-5-trifluoromethyl aniline,4-methyl-3-trifluoromethyl-phenylamine,4-methyl-5-trifluoromethylaniline,3-trifluoromethyl-p-toluidine,4-methyl-3-trifluoromethyl phenylamine |
| IUPAC Name | 4-methyl-3-(trifluoromethyl)aniline |
| InChI Key | JBCDCYFEJQHTTA-UHFFFAOYSA-N |
| Molecular Formula | C8H8F3N |
4-(4-Fluorophenoxy)benzaldehyde 98.0+%, TCI America™
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CAS: 137736-06-2 Molecular Formula: C13H9FO2 Molecular Weight (g/mol): 216.21 MDL Number: MFCD01631896 InChI Key: YUPBWHURNLRZQL-UHFFFAOYSA-N Synonym: 4-4-fluorophenoxy benzaldehyde,4-4'-fluorophenoxy benzaldehyde,4-4-fluoro-phenoxy-benzaldehyde,benzaldehyde, 4-4-fluorophenoxy,pubchem23015,acmc-209ceq,yupbwhurnlrzql-uhfffaoysa,4-4-fluorophenoxyl benzaldehyde,4-fluoro-4'-formyldiphenyl ether PubChem CID: 3856802 IUPAC Name: 4-(4-fluorophenoxy)benzaldehyde SMILES: FC1=CC=C(OC2=CC=C(C=O)C=C2)C=C1
| PubChem CID | 3856802 |
|---|---|
| CAS | 137736-06-2 |
| Molecular Weight (g/mol) | 216.21 |
| MDL Number | MFCD01631896 |
| SMILES | FC1=CC=C(OC2=CC=C(C=O)C=C2)C=C1 |
| Synonym | 4-4-fluorophenoxy benzaldehyde,4-4'-fluorophenoxy benzaldehyde,4-4-fluoro-phenoxy-benzaldehyde,benzaldehyde, 4-4-fluorophenoxy,pubchem23015,acmc-209ceq,yupbwhurnlrzql-uhfffaoysa,4-4-fluorophenoxyl benzaldehyde,4-fluoro-4'-formyldiphenyl ether |
| IUPAC Name | 4-(4-fluorophenoxy)benzaldehyde |
| InChI Key | YUPBWHURNLRZQL-UHFFFAOYSA-N |
| Molecular Formula | C13H9FO2 |
2-Hydroxybenzyl Alcohol 98.0+%, TCI America™
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CAS: 90-01-7 Molecular Formula: C7H8O2 Molecular Weight (g/mol): 124.14 MDL Number: MFCD00004617 InChI Key: CQRYARSYNCAZFO-UHFFFAOYSA-N Synonym: salicyl alcohol,2-hydroxybenzyl alcohol,saligenin,2-hydroxymethyl phenol,2-methylolphenol,o-hydroxybenzyl alcohol,saligenol,benzenemethanol, 2-hydroxy,diathesin,o-methylolphenol PubChem CID: 5146 ChEBI: CHEBI:16464 IUPAC Name: 2-(hydroxymethyl)phenol SMILES: OCC1=CC=CC=C1O
| PubChem CID | 5146 |
|---|---|
| CAS | 90-01-7 |
| Molecular Weight (g/mol) | 124.14 |
| ChEBI | CHEBI:16464 |
| MDL Number | MFCD00004617 |
| SMILES | OCC1=CC=CC=C1O |
| Synonym | salicyl alcohol,2-hydroxybenzyl alcohol,saligenin,2-hydroxymethyl phenol,2-methylolphenol,o-hydroxybenzyl alcohol,saligenol,benzenemethanol, 2-hydroxy,diathesin,o-methylolphenol |
| IUPAC Name | 2-(hydroxymethyl)phenol |
| InChI Key | CQRYARSYNCAZFO-UHFFFAOYSA-N |
| Molecular Formula | C7H8O2 |