Benzene and substituted derivatives
4-Methoxy-2-(trifluoromethyl)benzeneboronic acid
CAS: 313546-16-6 Molecular Formula: C8H8BF3O3 Molecular Weight (g/mol): 219.954 MDL Number: MFCD03095346 InChI Key: ZBCRZEJNAADYKG-UHFFFAOYSA-N Synonym: 4-methoxy-2-trifluoromethyl phenylboronic acid,4-methoxy-2-trifluoromethyl benzeneboronic acid,4-methoxy-2-trifluoromethyl phenyl boronic acid,4-methoxy-2-trifluoromethyl-phenylboronic acid,4-methoxy-2,pubchem1868,acmc-1aefl,ablock ab-13-0076 PubChem CID: 12109460 IUPAC Name: [4-methoxy-2-(trifluoromethyl)phenyl]boronic acid SMILES: B(C1=C(C=C(C=C1)OC)C(F)(F)F)(O)O
2-Fluorobenzyl chloride, 98+%
CAS: 345-35-7 Molecular Formula: C7H6ClF Molecular Weight (g/mol): 144.57 MDL Number: MFCD00000892 InChI Key: MOBRMRJUKNQBMY-UHFFFAOYSA-N Synonym: 2-fluorobenzyl chloride,1-chloromethyl-2-fluorobenzene,o-fluorobenzyl chloride,alpha-chloro-o-fluorotoluene,benzene, 1-chloromethyl-2-fluoro,alpha-chloro-2-fluorotoluene,2-fluorobenzylchloride,1-chloromethyl-2-fluoro-benzene,toluene, alpha-chloro-o-fluoro,o-fluorobenzylchloride PubChem CID: 9580 IUPAC Name: 1-(chloromethyl)-2-fluorobenzene SMILES: FC1=CC=CC=C1CCl
3,4-Dimethoxyaniline, Spectrum™ Chemical
CAS: 6315-89-5 Molecular Formula: C8H11NO2 Molecular Weight (g/mol): 153.18 InChI Key: LGDHZCLREKIGKJ-UHFFFAOYSA-N IUPAC Name: 3,4-dimethoxyaniline SMILES: COC1=CC=C(N)C=C1OC
2-Methyl-2-phenylpropanenitrile, 97%
CAS: 1195-98-8 Molecular Formula: C10H11N Molecular Weight (g/mol): 145.21 InChI Key: PGQTYXFMSZUGOW-UHFFFAOYSA-N Synonym: 2-methyl-2-phenyl-propionitrile,phenylisobutyronitrile,2-phenylisobutyronitrile,2-methyl-2-phenylpropionitrile,2-methyl-2-phenyl-propanenitrile,alpha,alpha-dimethylbenzyl cyanide,benzeneacetonitrile,a,a-dimethyl,alpha,alpha-dimethylphenylacetonitrile,benzeneacetonitrile,,a,,a-dimethyl,benzeneacetonitrile, alpha,alpha-dimethyl PubChem CID: 2797591 IUPAC Name: 2-methyl-2-phenylpropanenitrile SMILES: CC(C)(C#N)C1=CC=CC=C1
1-Benzyl-3-pyrroline, 97%, Thermo Scientific Chemicals
CAS: 6913-92-4 Molecular Formula: C11H13N Molecular Weight (g/mol): 159.23 InChI Key: LRFHKHHUKGZIGE-UHFFFAOYSA-N Synonym: 1-benzyl-3-pyrroline,1-benzyl-2,5-dihydro-1h-pyrrole,n-benzylpyrroline,n-benzyl-3-pyrroline,1h-pyrrole, 2,5-dihydro-1-phenylmethyl,maleimide-related compound 16,l-benzyl-3-pyrroline,n-benzyl 3-pyrroline,1-benzylpyrroline PubChem CID: 561506 IUPAC Name: 1-benzyl-2,5-dihydropyrrole SMILES: C1C=CCN1CC2=CC=CC=C2
trans-4-Bromo-beta-nitrostyrene, 99%
CAS: 5153-71-9 Molecular Formula: C8H6BrNO2 Molecular Weight (g/mol): 228.05 InChI Key: LSGVHLGCJIBLMB-AATRIKPKSA-N Synonym: 1-bromo-4-2-nitrovinyl benzene,e-1-bromo-4-2-nitrovinyl benzene,1-bromo-4-e-2-nitroethenyl benzene,trans-4-bromo-beta-nitrostyrene,benzene, 1-bromo-4-1e-2-nitroethenyl,beta-nitro-4-bromostyrene,4-bromo-.beta.-nitrostyrene,e-4-bromo-beta-nitrostyrene,1-bromo-4-e-2-nitrovinyl benzene PubChem CID: 688204 IUPAC Name: 1-bromo-4-[(E)-2-nitroethenyl]benzene SMILES: C1=CC(=CC=C1C=C[N+](=O)[O-])Br
N-Methoxy-N-methylbenzamide, 98%, Thermo Scientific™
CAS: 6919-61-5 Molecular Formula: C9H11NO2 Molecular Weight (g/mol): 165.19 InChI Key: UKERDACREYXSIV-UHFFFAOYSA-N Synonym: n-methyl-n-methoxybenzamide,benzamide, n-methoxy-n-methyl,n-methoxy-n-methyl-benzamide,methyl n-methylbenzohydroxamate,pubchem17496,acmc-1b5bp,n-methoxy-n-methylbenzamid,n-methoxy-n-methyl benzamide,ksc445c3n,n-methoxy-n-methylbenzamide PubChem CID: 569575 ChEBI: CHEBI:59742 IUPAC Name: N-methoxy-N-methylbenzamide SMILES: CN(C(=O)C1=CC=CC=C1)OC
Thermo Scientific Chemicals Salbutamol hemisulfate, 98%
CAS: 51022-70-9 Molecular Formula: C13H21NO3·1/2H2SO4 Molecular Weight (g/mol): 288.35 InChI Key: OVICLFZZVQVVFT-UHFFFAOYSA-N Synonym: salbutamol sulfate,albuterol sulfate,ventolin,ventorlin,4-2-tert-butylamino-1-hydroxyethyl-2-hydroxymethyl phenol sulfate,asthavent,albuterol sulfate 1:x,salbutamol; sulfuric acid,asmaven sulfate,2-tert-butylamino-1-4-hydroxy-3-hydroxymethylphenyl ethanol hemisulfate PubChem CID: 9884233 IUPAC Name: 4-[2-(tert-butylamino)-1-hydroxyethyl]-2-(hydroxymethyl)phenol;sulfuric acid SMILES: CC(C)(C)NCC(C1=CC(=C(C=C1)O)CO)O.OS(=O)(=O)O
2-Fluoro-6-nitrobenzyl bromide, 98%, Thermo Scientific™
CAS: 1958-93-6 Molecular Formula: C7H5BrFNO2 Molecular Weight (g/mol): 234.02 MDL Number: MFCD00042918 InChI Key: KKSODTKRSQTJFZ-UHFFFAOYSA-N PubChem CID: 74779 IUPAC Name: 2-(bromomethyl)-1-fluoro-3-nitrobenzene SMILES: [O-][N+](=O)C1=CC=CC(F)=C1CBr
2-(4-Bromophenyl)-1,3-dioxolane, 98+%
CAS: 10602-01-4 Molecular Formula: C9H9BrO2 Molecular Weight (g/mol): 229.07 MDL Number: MFCD01318950 InChI Key: ZYIMHOWVWWHLDN-UHFFFAOYSA-N Synonym: 2-4-bromophenyl-1,3-dioxolane,1-bromo-4-1,3-dioxolan-2-yl benzene,4-bromobenzaldehyde ethylene acetal,1,3-dioxolane,2-4-bromophenyl,2-4'-bromophenyl-1,3-dioxolane,1,3-dioxolane, 2-4-bromophenyl,bromophenyldioxolane,acmc-2098ib,2-4-bromophenyl dioxolane,4-bromobenzaldehyde ethylene ketal PubChem CID: 2773842 IUPAC Name: 2-(4-bromophenyl)-1,3-dioxolane SMILES: C1COC(O1)C2=CC=C(C=C2)Br
Thermo Scientific Chemicals 6-Carboxyfluorescein, 96%
CAS: 3301-79-9 Molecular Formula: C21H12O7 Molecular Weight (g/mol): 376.32 MDL Number: MFCD00036873 InChI Key: BZTDTCNHAFUJOG-UHFFFAOYSA-N Synonym: 6-carboxyfluorescein,6-fam,carboxyfluorescein,spiro isobenzofuran-1 3h ,9'-9h xanthene-6-carboxylic acid, 3',6'-dihydroxy-3-oxo,3,6,9-trihydroxyxanthen-9-yl terephthalic acid,3',6'-dihydroxy-3-oxo-3h-spiro 2-benzofuran-1,9'-xanthene-6-carboxylic acid,3',6'-dihydroxy-3-oxo-3h-spiro isobenzofuran-1,9'-xanthene-6-carboxylic acid,5 6-carboxy fluorescein,bidd:gt0504 PubChem CID: 76806 ChEBI: CHEBI:39073 IUPAC Name: 3',6'-dihydroxy-1-oxospiro[2-benzofuran-3,9'-xanthene]-5-carboxylic acid SMILES: C1=CC2=C(C=C1C(=O)O)C3(C4=C(C=C(C=C4)O)OC5=C3C=CC(=C5)O)OC2=O
2-Fluoro-4-methoxycarbonylphenylboronic acid, 98%, Thermo Scientific™
CAS: 603122-84-5 Molecular Formula: C8H8BFO4 Molecular Weight (g/mol): 197.96 MDL Number: MFCD08436034 InChI Key: BKWRLCIYMAYFPA-UHFFFAOYSA-N Synonym: 2-fluoro-4-methoxycarbonyl phenylboronic acid,2-fluoro-4-methoxycarbonyl benzeneboronic acid,4-methoxycarbonyl-2-fluorophenylboronic acid,2-fluoro-4-methoxycarbonyl phenyl boronic acid,o-fluoro p-methoxy carbonyl phenyl boronic acid,pubchem17434,acmc-209mj4,2-fluoro-4-methoxycarbonyl phenylboronicacid,2-fluoro-4-methoxycarbonyl-phenylboronic acid PubChem CID: 24824345 IUPAC Name: (2-fluoro-4-methoxycarbonylphenyl)boronic acid SMILES: COC(=O)C1=CC(F)=C(C=C1)B(O)O
1,2-Diamino-4,5-difluorobenzene, 97%
CAS: 76179-40-3 Molecular Formula: C6H6F2N2 Molecular Weight (g/mol): 144.13 MDL Number: MFCD00061131 InChI Key: PPWRHKISAQTCCG-UHFFFAOYSA-N Synonym: 1,2-diamino-4,5-difluorobenzene,4,5-difluoro-1,2-phenylenediamine,4,5-difluoro-o-phenylenediamine,2-amino-4,5-difluorophenylamine,4,5-difluoro-benzene-1,2-diamine,4,5-difluoro-1,2-benzenediamine,1,2-benzenediamine,4,5-difluoro,1,2-benzenediamine, 4,5-difluoro,pubchem4354,2-amino-4,5-difluoroaniline PubChem CID: 2736755 IUPAC Name: 4,5-difluorobenzene-1,2-diamine SMILES: NC1=CC(F)=C(F)C=C1N
4-(Methylsulfonyl)phenol, 95%, Thermo Scientific™
CAS: 14763-60-1 Molecular Formula: C7H8O3S Molecular Weight (g/mol): 172.20 MDL Number: MFCD00047806 InChI Key: KECCFSZFXLAGJS-UHFFFAOYSA-N Synonym: 4-methylsulfonyl phenol,4-methanesulfonylphenol,4-methanesulfonyl-phenol,4-hydroxyphenyl methyl sulfone,4-methylsulphonylphenol,phenol, p-methylsulfonyl,phenol, 4-methylsulfonyl,p-hydroxyphenyl methyl sulfone,p-methylsulfonyl phenol,unii-f7bif7zqj9 PubChem CID: 123350 IUPAC Name: 4-methylsulfonylphenol SMILES: CS(=O)(=O)C1=CC=C(O)C=C1
2-Fluoro-5-formylbenzonitrile, 99%
CAS: 218301-22-5 Molecular Formula: C8H4FNO Molecular Weight (g/mol): 149.12 MDL Number: MFCD01863558 InChI Key: MOFRJTLODZILCR-UHFFFAOYSA-N Synonym: 3-cyano-4-fluorobenzaldehyde,4-fluoro-3-cyanobenzaldehyde,2-fluoro-5-formyl-benzonitrile,benzonitrile, 2-fluoro-5-formyl,2-fluoro-5-formylbenzenecarbonitrile,2-fluor-5-formylbenzonitrile,10014 2-fluoro-5-formyl benzonitrile,pubchem2252,acmc-1cfa9,fluoro-5-formylbenzonitrile PubChem CID: 2769582 IUPAC Name: 2-fluoro-5-formylbenzonitrile SMILES: C1=CC(=C(C=C1C=O)C#N)F