Benzenoids
5-Methylpyrogallol 98.0+%, TCI America™
CAS: 609-25-6 Molecular Formula: C7H8O3 Molecular Weight (g/mol): 140.14 MDL Number: MFCD00017501 InChI Key: NYUABOGYMWADSF-UHFFFAOYSA-N Synonym: 3,4,5-Trihydroxytoluene PubChem CID: 587790 IUPAC Name: 5-methylbenzene-1,2,3-triol SMILES: CC1=CC(O)=C(O)C(O)=C1
3-Perylenecarboxaldehyde 95.0+%, TCI America™
CAS: 35438-63-2 Molecular Formula: C21H12O Molecular Weight (g/mol): 280.326 MDL Number: MFCD00127748 InChI Key: IQZOCQOQNWTNOW-UHFFFAOYSA-N Synonym: 3-Formylperylene PubChem CID: 3698916 IUPAC Name: perylene-3-carbaldehyde SMILES: C1=CC2=C3C(=C1)C4=C5C(=CC=C4)C(=CC=C5C3=CC=C2)C=O
2-Amino-1-naphthalenesulfonic Acid 98.0+%, TCI America™
CAS: 81-16-3 Molecular Formula: C10H9NO3S Molecular Weight (g/mol): 223.246 MDL Number: MFCD00003988 InChI Key: GWIAAIUASRVOIA-UHFFFAOYSA-N Synonym: tobias acid,2-amino-1-naphthalenesulfonic acid,2-naphthylamine-1-sulfonic acid,1-naphthalenesulfonic acid, 2-amino,kyselina tobiasova,unii-f9qkw1fce0,kyselina 2-naftylamin-1-sulfonova,kyselina tobiasova czech,ccris 9048,2-aminonaphthalene-1-sulphonic acid PubChem CID: 6670 IUPAC Name: 2-aminonaphthalene-1-sulfonic acid SMILES: C1=CC=C2C(=C1)C=CC(=C2S(=O)(=O)O)N
5-Chloro-2-nitrobenzaldehyde 98.0+%, TCI America™
CAS: 6628-86-0 Molecular Formula: C7H4ClNO3 Molecular Weight (g/mol): 185.563 MDL Number: MFCD00007289 InChI Key: SWGPIDCNYAYXMJ-UHFFFAOYSA-N Synonym: 2-nitro-5-chlorobenzaldehyde,5-chloro-2-nitro-benzaldehyde,benzaldehyde, 5-chloro-2-nitro,4-chloro-2-formylnitrobenzene,pubchem8199,acmc-1cuhe,ksc497q2h,5-chloro-2-nitro benzoaldehyde,5-chloro-2-nitrobenzaldehyde, technical grade PubChem CID: 81123 IUPAC Name: 5-chloro-2-nitrobenzaldehyde SMILES: C1=CC(=C(C=C1Cl)C=O)[N+](=O)[O-]
1-Bromo-4-pentylbenzene 90.0+%, TCI America™
CAS: 51554-95-1 Molecular Formula: C11H15Br Molecular Weight (g/mol): 227.145 MDL Number: MFCD00061113 InChI Key: SGCJPYYTVBHQGE-UHFFFAOYSA-N Synonym: 4-pentylbromobenzene,4-bromo-n-pentylbenzene,1-bromo-4-n-pentylbenzene,4-n-amylbromobenzene,4-n-pentylbromobenzene,1-bromo-4-pentyl-benzene,p-bromopentylbenzene,4-bromopentylbenzene,1-amyl-4-bromobenzene,benzene, 1-bromo-4-pentyl PubChem CID: 2735599 IUPAC Name: 1-bromo-4-pentylbenzene SMILES: CCCCCC1=CC=C(C=C1)Br
N-(tert-Butoxycarbonyl)-2-nitrobenzenesulfonamide 98.0+%, TCI America™
CAS: 198572-71-3 Molecular Formula: C11H14N2O6S Molecular Weight (g/mol): 302.30 MDL Number: MFCD06796217 InChI Key: WAYBGHIVTXTUCZ-UHFFFAOYSA-N Synonym: N-Boc-2-nitrobenzenesulfonamide PubChem CID: 11141172 IUPAC Name: tert-butyl N-(2-nitrobenzenesulfonyl)carbamate SMILES: CC(C)(C)OC(=O)NS(=O)(=O)C1=CC=CC=C1[N+]([O-])=O
Cloperastine Hydrochloride 97.0+%, TCI America™
CAS: 14984-68-0 Molecular Formula: C20H25Cl2NO Molecular Weight (g/mol): 366.33 MDL Number: MFCD00079012 InChI Key: UNPLRYRWJLTVAE-UHFFFAOYNA-N Synonym: 1-[2-[(4-Chlorophenyl)(phenyl)methoxy]ethyl]piperidine Hydrochloride, 4-Chlorobenzhydryl 2-(1-Piperidyl)ethyl Ether Hydrochloride PubChem CID: 161104 IUPAC Name: hydrogen 1-{2-[(4-chlorophenyl)(phenyl)methoxy]ethyl}piperidine chloride SMILES: [H+].[Cl-].ClC1=CC=C(C=C1)C(OCCN1CCCCC1)C1=CC=CC=C1
4'-Ethoxybenzylidene-4-butylaniline 99.0+%, TCI America™
CAS: 29743-08-6 Molecular Formula: C19H23NO Molecular Weight (g/mol): 281.399 MDL Number: MFCD00009465 InChI Key: DBOAVDSSZWDGTH-UHFFFAOYSA-N Synonym: EBBA PubChem CID: 94406 IUPAC Name: N-(4-butylphenyl)-1-(4-ethoxyphenyl)methanimine SMILES: CCCCC1=CC=C(C=C1)N=CC2=CC=C(C=C2)OCC
2,2',4-Trimethoxybenzophenone 98.0+%, TCI America™
CAS: 33077-87-1 Molecular Formula: C16H16O4 Molecular Weight (g/mol): 272.3 MDL Number: MFCD01098829 InChI Key: FUGHBBQOPVKADC-UHFFFAOYSA-N PubChem CID: 3507164 IUPAC Name: (2,4-dimethoxyphenyl)-(2-methoxyphenyl)methanone SMILES: COC1=CC(=C(C=C1)C(=O)C2=CC=CC=C2OC)OC
4-(Trifluoromethoxy)aniline 98.0+%, TCI America™
CAS: 461-82-5 Molecular Formula: C7H6F3NO Molecular Weight (g/mol): 177.126 MDL Number: MFCD00041314 InChI Key: XUJFOSLZQITUOI-UHFFFAOYSA-N Synonym: 4-trifluoromethoxy aniline,4-trifluoromethoxy-phenylamine,4-trifluoromethoxy benzenamine,p-trifluoromethoxyaniline,4-trifluoroethoxy aniline,benzenamine, 4-trifluoromethoxy,unii-p40l42cvf6,alpha,alpha,alpha-trifluoro-p-anisidine,p-aminotrifluoromethoxybenzene,4-amino-alpha,alpha,alpha-trifluoroanisole PubChem CID: 600848 IUPAC Name: 4-(trifluoromethoxy)aniline SMILES: C1=CC(=CC=C1N)OC(F)(F)F
2-Amino-3-bromo-5-nitrobenzonitrile 98.0+%, TCI America™
CAS: 17601-94-4 Molecular Formula: C7H4BrN3O2 Molecular Weight (g/mol): 242.032 MDL Number: MFCD00054185 InChI Key: MUHLVSZIVTURCZ-UHFFFAOYSA-N Synonym: benzonitrile, 2-amino-3-bromo-5-nitro,6-bromo-2-cyano-4-nitroaniline,2-bromo-6-cyano-4-nitroaniline,2-cyano-4-nitro-6-bromoaniline,2-amino-3-bromo-5-nitrobenzenecarbonitrile,pubchem2331,2-amino-3-bromo-1-cyano-5-nitrobenzene,acmc-1bus8,cambridge id 5228140,ksc496g6h PubChem CID: 87173 IUPAC Name: 2-amino-3-bromo-5-nitrobenzonitrile SMILES: C1=C(C=C(C(=C1Br)N)C#N)[N+](=O)[O-]
4-Amino-3-fluorobenzoic Acid 98.0+%, TCI America™
CAS: 455-87-8 Molecular Formula: C7H6FNO2 Molecular Weight (g/mol): 155.128 MDL Number: MFCD01660374 InChI Key: JSKXHTHMCCDEGD-UHFFFAOYSA-N Synonym: 3-fluoro-4-aminobenzoic acid,benzoic acid, 4-amino-3-fluoro,4-amino-3-fluorobenzenecarboxylic acid,4-amino-3-fluoro-benzoic acid,4-amino-3-fluorobenzoicacid,pubchem3524,wln: zr bf dvq,acmc-209k3i,3-14-00-01153 beilstein handbook reference,buttpark 44\09-60 PubChem CID: 9971 IUPAC Name: 4-amino-3-fluorobenzoic acid SMILES: C1=CC(=C(C=C1C(=O)O)F)N
3-Trifluoromethyl-5-nitrobenzoic Acid, TCI America™
CAS: 328-80-3 Molecular Formula: C8H4F3NO4 Molecular Weight (g/mol): 235.118 MDL Number: MFCD00024509 InChI Key: ODCLHXGXGFBBTA-UHFFFAOYSA-N Synonym: 3-nitro-5-trifluoromethyl benzoic acid,3-nitro-5-trifluoromethylbenzoic acid,3-trifluoromethyl-5-nitrobenzoic acid,3-carboxy-5-nitrobenzotrifluoride,3-nitro-5 trifluoromethyl benzoic acid,benzoic acid, 3-nitro-5-trifluoromethyl,pubchem4544,acmc-1cr4t,rarechem al bo 1012 PubChem CID: 616602 SMILES: C1=C(C=C(C=C1C(F)(F)F)[N+](=O)[O-])C(=O)O
2,6-Di-tert-butyl-4-ethylphenol 98.0+%, TCI America™
CAS: 4130-42-1 Molecular Formula: C16H26O Molecular Weight (g/mol): 234.38 MDL Number: MFCD00017366 InChI Key: BVUXDWXKPROUDO-UHFFFAOYSA-N Synonym: 2,6-di-tert-butyl-4-ethylphenol,ionol 2,4-ethyl-2,6-di-tert-butylphenol,phenol, 2,6-bis 1,1-dimethylethyl-4-ethyl,1-hydroxy-4-ethyl-2,6-di-tert-butylbenzene,phenol, 2,6-di-tert-butyl-4-ethyl,unii-sv7oz6j97m,2,6-bis 1,1-dimethylethyl-4-ethylphenol,yoshinox 250,sandant 425 PubChem CID: 20087 IUPAC Name: 2,6-di-tert-butyl-4-ethylphenol SMILES: CCC1=CC(=C(O)C(=C1)C(C)(C)C)C(C)(C)C
2-Isopropylphenol 98.0+%, TCI America™
CAS: 88-69-7 Molecular Formula: C9H12O Molecular Weight (g/mol): 136.194 MDL Number: MFCD00002224 InChI Key: CRBJBYGJVIBWIY-UHFFFAOYSA-N Synonym: 2-isopropylphenol,o-hydroxycumene,o-isopropylphenol,o-cumenol,1-hydroxy-2-isopropylbenzene,2-propan-2-yl phenol,2-1-methylethyl phenol,phenol, o-isopropyl,phenol, 2-1-methylethyl,isopropylphenol PubChem CID: 6943 ChEBI: CHEBI:38506 IUPAC Name: 2-propan-2-ylphenol SMILES: CC(C)C1=CC=CC=C1O