Benzenoids
2-Hydroxyterephthalic Acid 98.0+%, TCI America™
CAS: 636-94-2 Molecular Formula: C8H6O5 Molecular Weight (g/mol): 182.131 MDL Number: MFCD09835368 InChI Key: CDOWNLMZVKJRSC-UHFFFAOYSA-N PubChem CID: 97257 IUPAC Name: 2-hydroxyterephthalic acid SMILES: C1=CC(=C(C=C1C(=O)O)O)C(=O)O
4-Bromo-3-nitrobenzotrifluoride 98.0+%, TCI America™
CAS: 349-03-1 Molecular Formula: C7H3BrF3NO2 Molecular Weight (g/mol): 270.01 MDL Number: MFCD00014685 InChI Key: PESPBNYBZVIGRO-UHFFFAOYSA-N Synonym: 4-bromo-3-nitrobenzotrifluoride,1-bromo-2-nitro-4-trifluoromethyl benzene,2-nitro-4-trifluoromethylbromobenzene,3-nitro-4-bromobenzotrifluoride,2-bromo-5-trifluoromethyl nitrobenzene,4-bromo-3-nitro-a,a,a-trifluorotoluene,benzene, 1-bromo-2-nitro-4-trifluoromethyl,1-bromo-2-nitro-4-trifluoromethyl-benzene,2-bromo-1-nitro-5-trifluoromethyl benzene,toluene, 4-bromo-3-nitro-alpha,alpha,alpha-trifluoro PubChem CID: 520706 IUPAC Name: 1-bromo-2-nitro-4-(trifluoromethyl)benzene SMILES: [O-][N+](=O)C1=CC(=CC=C1Br)C(F)(F)F
1-Triphenylphosphoranylidene-2-propanone, 99%
CAS: 1439-36-7 Molecular Formula: C21H19OP Molecular Weight (g/mol): 318.36 MDL Number: MFCD00008774 InChI Key: KAANTNXREIRLCT-UHFFFAOYSA-N Synonym: acetylmethylene triphenylphosphorane,1-triphenylphosphoranylidene propan-2-one,1-triphenylphosphoranylidene-2-propanone,1-triphenylphosphoranylidene acetone,2-propanone, 1-triphenylphosphoranylidene,acetonylidenetriphenyl phosphorane,acetylmethylene triphenylphosphine,triphenylacetylmethylene phosphorane,2-propanone, triphenylphosphoranylidene,triphenylphosphoranylidene-2-propanone PubChem CID: 15038 IUPAC Name: 1-(triphenyl-$l^{5}-phosphanylidene)propan-2-one SMILES: CC(=O)C=P(C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1
1,4-Dibromobenzene, 99%
CAS: 106-37-6 Molecular Formula: C6H4Br2 Molecular Weight (g/mol): 235.91 MDL Number: MFCD00000089 InChI Key: SWJPEBQEEAHIGZ-UHFFFAOYSA-N Synonym: p-dibromobenzene,p-bromophenyl bromide,benzene, 1,4-dibromo,benzene, p-dibromo,p-benzene dibromide,1,4-dibromo benzene,1,4-dibromo-benzene,unii-9991w3m5hz,dibromobenzene, 1,4,labotest-bb ltbb002071 PubChem CID: 7804 ChEBI: CHEBI:37150 IUPAC Name: 1,4-dibromobenzene SMILES: BrC1=CC=C(Br)C=C1
4-Hydroxy-3-methoxybenzyl alcohol, 99%
CAS: 498-00-0 Molecular Formula: C8H10O3 Molecular Weight (g/mol): 154.17 MDL Number: MFCD00004659 InChI Key: ZENOXNGFMSCLLL-UHFFFAOYSA-N Synonym: vanillyl alcohol,4-hydroxy-3-methoxybenzyl alcohol,4-hydroxymethyl-2-methoxyphenol,vanillin alcohol,vanillic alcohol,4-hydroxy-3-methoxybenzenemethanol,benzenemethanol, 4-hydroxy-3-methoxy,vanillol,4-hydroxy-3-methoxybenzylalcohol,4-hydroxy-3-methoxyphenylmethanol PubChem CID: 62348 ChEBI: CHEBI:18353 IUPAC Name: 4-(hydroxymethyl)-2-methoxyphenol SMILES: COC1=CC(CO)=CC=C1O
Anthracene-9-carboxylic acid, 98+%
CAS: 723-62-6 Molecular Formula: C15H10O2 Molecular Weight (g/mol): 222.24 MDL Number: MFCD00001257 InChI Key: XGWFJBFNAQHLEF-UHFFFAOYSA-N Synonym: 9-anthracenecarboxylic acid,9-anthroic acid,anca,9-carboxyanthracene,9-ac,anthracene-10-carboxylic acid,9-anthracene carboxylic acid,a9c,spectrum_001457,tocris-0963 PubChem CID: 2201 ChEBI: CHEBI:34507 IUPAC Name: anthracene-9-carboxylic acid SMILES: OC(=O)C1=C2C=CC=CC2=CC2=CC=CC=C12
4-(Bromomethyl)benzaldehyde, 97%, Thermo Scientific™
CAS: 51359-78-5 Molecular Formula: C8H7BrO Molecular Weight (g/mol): 199.047 InChI Key: XYPVBKDHERGKJG-UHFFFAOYSA-N PubChem CID: 11206421 IUPAC Name: 4-(bromomethyl)benzaldehyde SMILES: C1=CC(=CC=C1CBr)C=O
2-Fluorobenzyl bromide, 98%
CAS: 446-48-0 Molecular Formula: C7H6BrF Molecular Weight (g/mol): 189.03 MDL Number: MFCD00000324 InChI Key: FFWQLZFIMNTUCZ-UHFFFAOYSA-N Synonym: 2-fluorobenzyl bromide,1-bromomethyl-2-fluorobenzene,2-fluorobenzylbromide,o-fluorobenzyl bromide,alpha-bromo-o-fluorotoluene,alpha-bromo-2-fluorotoluene,2-fluoro-benzyl bromide,1-bromomethyl-2-fluoro-benzene,benzene, 1-bromomethyl-2-fluoro,2-fluoro-benzylbromide PubChem CID: 67968 IUPAC Name: 1-(bromomethyl)-2-fluorobenzene SMILES: C1=CC=C(C(=C1)CBr)F
4-(2-Methoxyethyl)phenol, 98%
CAS: 56718-71-9 Molecular Formula: C9H12O2 Molecular Weight (g/mol): 152.193 MDL Number: MFCD00017537 InChI Key: FAYGEALAEQKPDI-UHFFFAOYSA-N Synonym: 4-2-methoxyethyl phenol,p-2-methoxyethyl phenol,phenol, 4-2-methoxyethyl,4-methoxyethylphenol,unii-py1w0akw8i,metoprolol impurity b,metoprolol impurity i,py1w0akw8i,4-hydroxyphenylethyl methyl ether PubChem CID: 92516 IUPAC Name: 4-(2-methoxyethyl)phenol SMILES: COCCC1=CC=C(C=C1)O
4-tert-Butylthiophenol, 97%
CAS: 2396-68-1 Molecular Formula: C10H14S Molecular Weight (g/mol): 166.282 MDL Number: MFCD00022067 InChI Key: GNXBFFHXJDZGEK-UHFFFAOYSA-N Synonym: 4-tert-butylthiophenol,p-tert-butylthiophenol,benzenethiol, p-tert-butyl,p-tert-butylbenzenethiol,p-t-butylthiophenol,p-tert-butylphenyl mercaptan,benzenethiol, 4-1,1-dimethylethyl,benzenethiol, p-tert-butylthio,4-tert-butyl thiophenol,4-t-butylthiophenol PubChem CID: 75454 IUPAC Name: 4-tert-butylbenzenethiol SMILES: CC(C)(C)C1=CC=C(C=C1)S
Tris(dibenzylideneacetone)dipalladium-chloroform adduct, 97%
CAS: 52522-40-4 Molecular Formula: C52H43Cl3O3Pd2 Molecular Weight (g/mol): 1035.10 MDL Number: MFCD00075479 InChI Key: LNAMMBFJMYMQTO-UHFFFAOYSA-N Synonym: tris dibenzylideneacetone dipalladium-chloroform adduct,tris dibenylideneacetone dipalladium-chloroform,tris dibenzylideneacetone dipalladium 0 chloroform adduct,tris dibenzylideneacetone dipalladium 0-chloroform adduct,tris dibenzylideneacetone dipalladium chloroform adduct,tris dibenzylideneacetone dipalladium-chloroform,pd2 dba 3 chcl3,tris dibenzylideneacetone chloroform-di-palladium 0,tris dibenzylideneacetone dipalladium chloroform complex PubChem CID: 11029508 IUPAC Name: chloroform;(1E,4E)-1,5-diphenylpenta-1,4-dien-3-one;palladium SMILES: [Pd].[Pd].ClC(Cl)Cl.O=C(C=CC1=CC=CC=C1)C=CC1=CC=CC=C1.O=C(C=CC1=CC=CC=C1)C=CC1=CC=CC=C1.O=C(C=CC1=CC=CC=C1)C=CC1=CC=CC=C1
Bis(2-ethylhexyl) terephthalate, 97%
CAS: 6422-86-2 Molecular Formula: C24H38O4 Molecular Weight (g/mol): 390.55 MDL Number: MFCD00072256 InChI Key: RWPICVVBGZBXNA-UHFFFAOYSA-N Synonym: bis 2-ethylhexyl terephthalate,kodaflex dotp,di-2-ethylhexyl terephthalate,1,4-benzenedicarboxylic acid, bis 2-ethylhexyl ester,terephthalic acid, bis 2-ethylhexyl ester,eastman 168,ccris 7052,di 2-ethylhexyl terephthalate,bis 2-ethylhexyl benzene-1,4-dicarboxylate,1,4-benzenedicarboxylic acid, 1,4-bis 2-ethylhexyl ester PubChem CID: 22932 IUPAC Name: bis(2-ethylhexyl) benzene-1,4-dicarboxylate SMILES: CCCCC(CC)COC(=O)C1=CC=C(C=C1)C(=O)OCC(CC)CCCC
4,4'-Methylenebis(phenyl isocyanate), 98%
CAS: 101-68-8 Molecular Formula: C15H10N2O2 Molecular Weight (g/mol): 250.257 MDL Number: MFCD00036131 InChI Key: UPMLOUAZCHDJJD-UHFFFAOYSA-N Synonym: 4,4'-diphenylmethane diisocyanate,diphenylmethane diisocyanate,isonate,4,4'-diisocyanatodiphenylmethane,p,p'-diphenylmethane diisocyanate,bis 4-isocyanatophenyl methane,4,4'-methylenebis phenyl isocyanate,methylbisphenyl isocyanate,1,1'-methylenebis 4-isocyanatobenzene,methylene diphenyl diisocyanate PubChem CID: 7570 ChEBI: CHEBI:53218 IUPAC Name: 1-isocyanato-4-[(4-isocyanatophenyl)methyl]benzene SMILES: C1=CC(=CC=C1CC2=CC=C(C=C2)N=C=O)N=C=O
1-Naphthol 99.0+%, TCI America™
CAS: 90-15-3 Molecular Formula: C10H8O Molecular Weight (g/mol): 144.173 MDL Number: MFCD00003930 InChI Key: KJCVRFUGPWSIIH-UHFFFAOYSA-N Synonym: 1-naphthol,1-naphthalenol,alpha-naphthol,1-hydroxynaphthalene,naphthol,fouramine ern,fourrine ern,tertral ern,furro er,basf ursol ern PubChem CID: 7005 ChEBI: CHEBI:10319 IUPAC Name: naphthalen-1-ol SMILES: C1=CC=C2C(=C1)C=CC=C2O
(4-Carboxybutyl)triphenylphosphonium bromide, 98%
CAS: 17814-85-6 Molecular Formula: C23H24BrO2P Molecular Weight (g/mol): 443.32 MDL Number: MFCD00011906 InChI Key: MLOSJPZSZWUDSK-UHFFFAOYSA-N Synonym: 4-carboxybutyl triphenylphosphonium bromide,phosphonium, 4-carboxybutyl triphenyl-, bromide,4-carboxybutyl triphenylphosphanium bromide,carboxybutyltriphenylphosphonium bromide,5-triphenylphosphonio pentanoic acid bromide,4-carboxybutyl-triphenylphosphonium bromide,triphenyl 4-carboxybutyl phosphonium bromide,4-carboxybutyl triphenyl phosphonium bromide PubChem CID: 161236 IUPAC Name: 4-carboxybutyl(triphenyl)phosphanium;bromide SMILES: [Br-].OC(=O)CCCC[P+](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1