Benzenoids
2,3,5,6-Tetrafluorothiophenol, 98%
CAS: 769-40-4 Molecular Formula: C6H2F4S Molecular Weight (g/mol): 182.136 MDL Number: MFCD00004829 InChI Key: IGOGJHYWSOZGAE-UHFFFAOYSA-N Synonym: 2,3,5,6-tetrafluorothiophenol,2,3,5,6-tetrafluorobenzene-1-thiol,benzenethiol, 2,3,5,6-tetrafluoro,2,3,5,6-tetrafluorbenzolthiol,timtec-bb sbb000230,#,2,3,5,6-tetrafluorophenyl hydrosulfide,2,3,5,6-tetrafluorobenzenethiol PubChem CID: 69859 IUPAC Name: 2,3,5,6-tetrafluorobenzenethiol SMILES: C1=C(C(=C(C(=C1F)F)S)F)F
4-Chloro-2-nitrotoluene, 99%
CAS: 89-59-8 Molecular Formula: C7H6ClNO2 Molecular Weight (g/mol): 171.58 MDL Number: MFCD00007215 InChI Key: SQFLFRQWPBEDHM-UHFFFAOYSA-N Synonym: 4-chloro-2-nitrotoluene,2-nitro-4-chlorotoluene,benzene, 4-chloro-1-methyl-2-nitro,4,2-chloronitrotoluene,p-chloro-o-nitrotoluene,toluene, 4-chloro-2-nitro,4-chloro-1-methyl-2-nitro-benzene,ccris 3116,4-chlor-2-nitrotoluol,pubchem18919 PubChem CID: 6975 IUPAC Name: 4-chloro-1-methyl-2-nitrobenzene SMILES: CC1=CC=C(Cl)C=C1[N+]([O-])=O
1-Bromo-4-n-octylbenzene, 97%
CAS: 51554-93-9 Molecular Formula: C14H21Br Molecular Weight (g/mol): 269.226 MDL Number: MFCD00038348 InChI Key: OOZQSVXPBCINJF-UHFFFAOYSA-N Synonym: 1-4-bromophenyl octane,1-bromo-4-n-octylbenzene,p-octylbromobenzene,p-bromophenyloctane,4-n-octylbromobenzene,1-p-bromophenyl octane,4-bromooctylbenzene,4-oct-1-yl bromobenzene,benzene, 1-bromo-4-octyl,4-bromo-1-octylbenzene PubChem CID: 142854 IUPAC Name: 1-bromo-4-octylbenzene SMILES: CCCCCCCCC1=CC=C(C=C1)Br
4,4-Diphenyl-2-butanone, 98%
CAS: 5409-60-9 Molecular Formula: C16H16O Molecular Weight (g/mol): 224.303 MDL Number: MFCD00017619 InChI Key: FPHXYKLKNOEKTQ-UHFFFAOYSA-N Synonym: 4,4-diphenyl-2-butanone,4,4'-diphenyl-2-butanone,benzhydrylaceton,acmc-20amsh,4,4-diphenyl-butan-2-one,2-butanone,4,4-diphenyl,methyl-2,2-diphenylethyl ketone PubChem CID: 79421 IUPAC Name: 4,4-diphenylbutan-2-one SMILES: CC(=O)CC(C1=CC=CC=C1)C2=CC=CC=C2
1-Bromo-3-iodobenzene, 98%
CAS: 591-18-4 Molecular Formula: C6H4BrI Molecular Weight (g/mol): 282.91 MDL Number: MFCD00001043 InChI Key: CTPUUDQIXKUAMO-UHFFFAOYSA-N Synonym: 3-bromoiodobenzene,benzene, 1-bromo-3-iodo,m-bromoiodobenzene,1-bromo-3-iodo-benzene,3-bromo-1-iodobenzene,attercop-chm at127411,m-bromjodbenzol,3-iodobromobenzene,3-bromo iodobenzene PubChem CID: 11561 IUPAC Name: 1-bromo-3-iodobenzene SMILES: BrC1=CC=CC(I)=C1
o-Dianisidine, 98+%
CAS: 119-90-4 Molecular Formula: C14H16N2O2 Molecular Weight (g/mol): 244.294 MDL Number: MFCD00008372 InChI Key: JRBJSXQPQWSCCF-UHFFFAOYSA-N Synonym: 3,3'-dimethoxybenzidine,o-dianisidine,dianisidine,cellitazol b,neutrosel navy bn,diacel navy dc,disperse black 6,blue base nb,blue bn base,blue base irga b PubChem CID: 8411 ChEBI: CHEBI:82321 IUPAC Name: 4-(4-amino-3-methoxyphenyl)-2-methoxyaniline SMILES: COC1=C(C=CC(=C1)C2=CC(=C(C=C2)N)OC)N
3,5-Dinitrobenzoic acid, 98+%
CAS: 99-34-3 Molecular Formula: C7H4N2O6 Molecular Weight (g/mol): 212.12 MDL Number: MFCD00007253 InChI Key: VYWYYJYRVSBHJQ-UHFFFAOYSA-N Synonym: 3,5-dinitrobenzoic acid,dinitrobenzoic acid,dnba,benzoic acid, 3,5-dinitro,3-carboxy-1,5-dinitrobenzene,3,5-dinitro-benzoic acid,unii-4v3f9q018p,ccris 3129,3,5-dnba,3,5-dinitrobenzenecarboxylic acid PubChem CID: 7433 ChEBI: CHEBI:73914 IUPAC Name: 3,5-dinitrobenzoic acid SMILES: OC(=O)C1=CC(=CC(=C1)[N+]([O-])=O)[N+]([O-])=O
2,4,6-Trifluorobenzoyl chloride, 97%
CAS: 79538-29-7 Molecular Formula: C7H2ClF3O Molecular Weight (g/mol): 194.537 MDL Number: MFCD00070810 InChI Key: SIFIJQFBERMWMU-UHFFFAOYSA-N Synonym: 2,4,6-trifluorobenzoylchloride,2,4,6-trifluoro-benzoyl chloride,acmc-20aof3,timtec-bb sbb005827,2,4,6-tri-fluorobenzoyl chloride,2,4,6-trifluorobenzoyl chloride,benzoyl chloride,2,4,6-trifluoro,benzoyl chloride, 2,4,6-trifluoro,2,4,6-trifluorobenzoyl chloride 1g,benzoyl chloride, 2,4,6-trifluoro-9ci PubChem CID: 144895 IUPAC Name: 2,4,6-trifluorobenzoyl chloride SMILES: C1=C(C=C(C(=C1F)C(=O)Cl)F)F
Salbutamol hemisulfate, 98+%
CAS: 51022-70-9 Molecular Formula: C13H23NO7S Molecular Weight (g/mol): 337.387 MDL Number: MFCD00055200 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-3-(trifluoromethyl)benzoic acid, 98%
CAS: 115029-22-6 Molecular Formula: C8H3F4O2 Molecular Weight (g/mol): 207.10 MDL Number: MFCD00040980 InChI Key: XVEAMDNSCPPPCP-UHFFFAOYSA-M Synonym: 2-fluoro-3-trifluoromethyl benzoic acid,2-fluoro-3-trifluoromethyl benzoicacid,alpha,alpha,alpha,2-tetrafluoro-m-toluic acid,2-fluoro-3-trifluoromethyl-benzoic acid,benzoic acid, 2-fluoro-3-trifluoromethyl,2-fluoro-3-trifluoromethylbenzioc acid,pubchem2741,acmc-1boz3,ksc489q1l,rarechem al bo 0625 PubChem CID: 518002 IUPAC Name: 2-fluoro-3-(trifluoromethyl)benzoic acid SMILES: [O-]C(=O)C1=CC=CC(=C1F)C(F)(F)F
4-Amino-3-chlorophenol hydrochloride, 98%
CAS: 52671-64-4 Molecular Formula: C6H7Cl2NO Molecular Weight (g/mol): 180.028 MDL Number: MFCD00143110 InChI Key: RFJVQGMBFQGZPV-UHFFFAOYSA-N Synonym: 4-amino-3-chlorophenol hydrochloride,4-amino-3-chlorophenol hcl,2-chloro-4-hydroxyaniline hydrochloride,phenol, 4-amino-3-chloro-, hydrochloride,4-azanyl-3-chloranyl-phenol hydrochloride,c6h6clno.hcl,acmc-209l0t,ksc495i8f,4-amino-3-chlorophenol, chloride,3-chloro-4-aminophenol hydrochloride PubChem CID: 12598190 IUPAC Name: 4-amino-3-chlorophenol;hydrochloride SMILES: C1=CC(=C(C=C1O)Cl)N.Cl
2-(1-Piperazinyl)phenol, 98%
CAS: 1011-17-2 Molecular Formula: C10H14N2O Molecular Weight (g/mol): 178.235 MDL Number: MFCD00190246 InChI Key: UORNTHBBLYBAJJ-UHFFFAOYSA-N Synonym: 2-piperazin-1-yl phenol,1-2-hydroxyphenyl piperazine,2-1-piperazinyl phenol,2-1-piperazino phenol,o-1-piperazinyl phenol,2-piperazin-1-yl-phenol,n-2-hydroxyphenyl piperazine,phenol, 2-1-piperazinyl,1-2-hydroxyphenyl-piperazine,2-piperazinylphenol PubChem CID: 70530 IUPAC Name: 2-piperazin-1-ylphenol SMILES: C1CN(CCN1)C2=CC=CC=C2O
3-(Trifluoromethylthio)benzoic acid, 97%
CAS: 946-65-6 Molecular Formula: C8H4F3O2S Molecular Weight (g/mol): 221.17 MDL Number: MFCD00236337 InChI Key: IVGAPIVNQABETQ-UHFFFAOYSA-M Synonym: 3-trifluoromethylthio benzoic acid,3-trifluoromethyl thio benzoic acid,3-trifluoromethyl sulfanyl benzoic acid,3-trifluoromethylsulfanyl benzoic acid,3-trifluoromethylsulfanyl-benzoic acid,benzoic acid, 3-trifluoromethyl thio,3-trifluoromethyl sulphanyl benzoic acid,3-trifluoromethylthio benzoicacid,3-carboxyphenyl trifluoromethyl sulphide PubChem CID: 688330 IUPAC Name: 3-(trifluoromethylsulfanyl)benzoic acid SMILES: [O-]C(=O)C1=CC=CC(SC(F)(F)F)=C1
4-Sulfobenzoic acid monopotassium salt, 95%
CAS: 5399-63-3 Molecular Formula: C7H5KO5S Molecular Weight (g/mol): 240.27 MDL Number: MFCD00007509 InChI Key: PXRJBUPXKDXDLG-UHFFFAOYSA-M Synonym: benzoic acid, 4-sulfo-, monopotassium salt,4-sulfobenzoic acid monopotassium salt,4-sulphobenzoic acid monopotassium salt,4-sulfobenzoicacidmonopotassiumsalt,potassium hydrogen 4-sulphonatobenzoate,p-sulphobenzoic acid, monopotassium salt,potassium 4-sulphobenzoate,benzoic acid, 4-sulfo-, potassium salt 1:1,potassium 4-sulfobenzoate,p-potassiooxysulfonyl benzoic acid PubChem CID: 23670833 IUPAC Name: potassium;4-sulfobenzoate SMILES: C1=CC(=CC=C1C(=O)[O-])S(=O)(=O)O.[K+]
4-(Trifluoromethoxy)anisole, 98+%
CAS: 710-18-9 Molecular Formula: C8H7F3O2 Molecular Weight (g/mol): 192.137 MDL Number: MFCD00216942 InChI Key: NOAFZIOGGDPYKK-UHFFFAOYSA-N Synonym: 4-trifluoromethoxy anisole,1-methoxy-4-trifluoromethoxy benzene,p-trifluoromethoxy anisole,4-trifluoromethoxyanisole,benzene, 1-methoxy-4-trifluoromethoxy,4-methoxy trifluoromethoxy benzene,hydroquinone methyl trifluoromethyl ether,trifluoro 4-methoxyphenoxy methane,pubchem3570,acmc-1bcz3 PubChem CID: 2724973 IUPAC Name: 1-methoxy-4-(trifluoromethoxy)benzene SMILES: COC1=CC=C(C=C1)OC(F)(F)F