Benzene and substituted derivatives
Tolbutamide, 98%
CAS: 64-77-7 Molecular Formula: C12H18N2O3S Molecular Weight (g/mol): 270.347 MDL Number: MFCD00027169 InChI Key: JLRGJRBPOGGCBT-UHFFFAOYSA-N Synonym: tolbutamide,orinase,1-butyl-3-tosylurea,tolbutamid,aglicid,arkozal,artosin,diabetol,dolipol,rastinon PubChem CID: 5505 ChEBI: CHEBI:27999 IUPAC Name: 1-butyl-3-(4-methylphenyl)sulfonylurea SMILES: CCCCNC(=O)NS(=O)(=O)C1=CC=C(C=C1)C
2-(2-Bromophenyl)-1,3-dioxolane, 98%
CAS: 34824-58-3 Molecular Formula: C9H9BrO2 Molecular Weight (g/mol): 229.07 MDL Number: MFCD00155124 InChI Key: IWSGKSUCFVOWQU-UHFFFAOYSA-N Synonym: 2-2-bromophenyl-1,3-dioxolane,2-bromobenzaldehyde ethylene acetal,1,3-dioxolane, 2-2-bromophenyl,1-bromo-2-1,3-dioxolan-2-yl benzene,2-bromophenyldioxolane,2-bromo benzaldehyde ethylene glycol acetal,2-2-bromo-phenyl-1,3 dioxolane,pubchem3729,acmc-1csyy,bromobenzaldehyde ethylene acetal PubChem CID: 553534 IUPAC Name: 2-(2-bromophenyl)-1,3-dioxolane SMILES: BrC1=CC=CC=C1C1OCCO1
4-Fluoro-3-nitrobenzaldehyde, 97%, Thermo Scientific™
CAS: 42564-51-2 Molecular Formula: C7H4FNO3 Molecular Weight (g/mol): 169.11 MDL Number: MFCD01861388 InChI Key: ILKWFRCNNILIJW-UHFFFAOYSA-N Synonym: 3-nitro-4-fluorobenzaldehyde,benzaldehyde, 4-fluoro-3-nitro,4-fluoro-3-nitro-benzaldehyde,pubchem22572,acmc-1ao2q,3-nitro-4 fluorobenzaldehyde,ksc497m9r,2-fluoro-5-formylnitrobenzene,#,4-fluoranyl-3-nitro-benzaldehyde PubChem CID: 598129 IUPAC Name: 4-fluoro-3-nitrobenzaldehyde SMILES: C1=CC(=C(C=C1C=O)[N+](=O)[O-])F
4-Chloro-2-methoxybenzyl alcohol, 97%, Thermo Scientific Chemicals
CAS: 55685-75-1 Molecular Formula: C8H9ClO2 Molecular Weight (g/mol): 172.61 MDL Number: MFCD02683547 InChI Key: AXXPZAITCCIOIA-UHFFFAOYSA-N Synonym: 4-chloro-2-methoxybenzyl alcohol,4-chloro-2-methoxyphenyl methanol,4-chloro-2-methoxy-phenyl-methanol,benzenemethanol, 4-chloro-2-methoxy,4-chloro-2-methoxybenzyl alcohol 97 PubChem CID: 3549393 IUPAC Name: (4-chloro-2-methoxyphenyl)methanol SMILES: COC1=C(CO)C=CC(Cl)=C1
(1-Ethoxycarbonylethylidene)triphenylphosphorane, 97%
CAS: 5717-37-3 Molecular Formula: C23H23O2P Molecular Weight (g/mol): 362.41 MDL Number: MFCD00009160 InChI Key: KZENFXVDPUMQOE-UHFFFAOYSA-N Synonym: ethyl 2-triphenylphosphoranylidene propanoate,carbethoxyethylidene triphenylphosphorane,ethyl 2-triphenylphosphoranylidene propionate,1-ethoxycarbonylethylidene triphenylphosphorane,propanoic acid, 2-triphenylphosphoranylidene-, ethyl ester,1-ethoxycarbonyl ethylidenetriphenylphosphorane,ethyl 2-triphenyl-lambda5-phosphanylidene propanoate,ethyl 2-triphenyl-$l^ 5-phosphanylidene propanoate,1-ethoxycarbonylethylethylidene triphenylphosporane,carbethoxyethylidine triphenylphosphorane PubChem CID: 79792 IUPAC Name: ethyl 2-(triphenyl-$l^{5}-phosphanylidene)propanoate SMILES: CCOC(=O)C(C)=P(C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1
3-Hydroxybenzyl alcohol, 97%
CAS: 620-24-6 Molecular Formula: C7H8O2 Molecular Weight (g/mol): 124.139 MDL Number: MFCD00004643 InChI Key: OKVJCVWFVRATSG-UHFFFAOYSA-N Synonym: 3-hydroxybenzyl alcohol,3-hydroxymethyl phenol,benzenemethanol, 3-hydroxy,3-methylolphenol,m-hydroxybenzyl alcohol,3-hydroxybenzenemethanol,benzyl alcohol, m-hydroxy,3-hydroxybenzylalcohol,3-oh-benzyl-alcohol,3-hydroxymethyl-phenol PubChem CID: 102 ChEBI: CHEBI:17069 IUPAC Name: 3-(hydroxymethyl)phenol SMILES: C1=CC(=CC(=C1)O)CO
1-Bromo-3-(trifluoromethoxy)benzene, 98+%, Thermo Scientific Chemicals
CAS: 2252-44-0 Molecular Formula: C7H4BrF3O Molecular Weight (g/mol): 241.007 MDL Number: MFCD00040943 InChI Key: WVUDHWBCPSXAFN-UHFFFAOYSA-N Synonym: 1-bromo-3-trifluoromethoxy benzene,3-trifluoromethoxy bromobenzene,3-bromo trifluoromethoxy benzene,m-bromo trifluoromethoxy benzene,3-bromo-1-trifluoromethoxy benzene,benzene, 1-bromo-3-trifluoromethoxy,3-bromo-alpha,alpha,alpha-trifluoroanisole,bromo-3-trifluoromethoxy benzene,buttpark 91\57-27,1-bromo-3-trifluoromethoxy-benzene PubChem CID: 519964 IUPAC Name: 1-bromo-3-(trifluoromethoxy)benzene SMILES: C1=CC(=CC(=C1)Br)OC(F)(F)F
3-(Trifluoromethyl)aniline, 99%
CAS: 98-16-8 Molecular Formula: C7H6F3N Molecular Weight (g/mol): 161.127 MDL Number: MFCD00007797 InChI Key: VIUDTWATMPPKEL-UHFFFAOYSA-N Synonym: 3-trifluoromethyl aniline,3-aminobenzotrifluoride,m-aminobenzotrifluoride,3-aminotrifluorotoluene,benzenamine, 3-trifluoromethyl,3-trifluoromethyl benzenamine,m-abtf,m-trifluoromethylaniline,m-amino trifluorotoluene,m-trifluoromethyl aniline PubChem CID: 7375 IUPAC Name: 3-(trifluoromethyl)aniline SMILES: C1=CC(=CC(=C1)N)C(F)(F)F
2-Fluorophenyl isothiocyanate, 97%
CAS: 38985-64-7 Molecular Formula: C7H4FNS Molecular Weight (g/mol): 153.17 MDL Number: MFCD00004800 InChI Key: OAGDRIUTLPDSMJ-UHFFFAOYSA-N Synonym: 2-fluorophenyl isothiocyanate,o-fluorophenyl isothiocyanate,benzene, 1-fluoro-2-isothiocyanato,2-fluorophenylisothiocyanate,1-fluoro-2-isothiocyanato-benzene,isothiocyanic acid 2-fluorophenyl ester,benzene,1-fluoro-2-isothiocyanato,o-fluoro phenyl isothiocyanate,2-fluorobenzenisothiocyanate,timtec-bb sbb006546 PubChem CID: 97520 IUPAC Name: 1-fluoro-2-isothiocyanatobenzene SMILES: FC1=CC=CC=C1N=C=S
4-Bromobenzhydrazide, 98+%
CAS: 5933-32-4 Molecular Formula: C7H7BrN2O Molecular Weight (g/mol): 215.05 MDL Number: MFCD00007602 InChI Key: UYIMBYKIIMYFPS-UHFFFAOYSA-N Synonym: 4-bromobenzhydrazide,p-bromobenzhydrazide,4-bromobenzoic hydrazide,p-bromobenzohydrazide,p-bromobenzoic acid hydrazide,4-bromobenzoylhydrazine,4-bromobenzoic acid hydrazide,benzoic acid, 4-bromo-, hydrazide,4-bromo-benzoic acid hydrazide,p-bromobenzoylhydrazine PubChem CID: 22219 IUPAC Name: 4-bromobenzohydrazide SMILES: C1=CC(=CC=C1C(=O)NN)Br
4-Iodo-2-nitrotoluene, 97%
CAS: 41252-97-5 Molecular Formula: C7H6INO2 Molecular Weight (g/mol): 263.034 MDL Number: MFCD00051090 InChI Key: QLMRDNPXYNJQMQ-UHFFFAOYSA-N Synonym: 4-iodo-2-nitrotoluene,benzene, 4-iodo-1-methyl-2-nitro,pubchem15938,2-nitro-4-iodotoluene,acmc-1apfk,maybridge1_008109,ksc493s9d,4-iodo-1-methyl-2-nitro-benzene PubChem CID: 170481 IUPAC Name: 4-iodo-1-methyl-2-nitrobenzene SMILES: CC1=C(C=C(C=C1)I)[N+](=O)[O-]
4-tert-Butyltoluene, 95%
CAS: 98-51-1 Molecular Formula: C11H16 Molecular Weight (g/mol): 148.249 MDL Number: MFCD00008837 InChI Key: QCWXDVFBZVHKLV-UHFFFAOYSA-N Synonym: 4-tert-butyltoluene,p-tert-butyltoluene,1-tert-butyl-4-methylbenzene,p-t-butyltoluene,benzene, 1-1,1-dimethylethyl-4-methyl,4-t-butyltoluene,p-methyl-tert-butylbenzene,toluene, p-tert-butyl,1-methyl-4-tert-butylbenzene,4-methyl-tert-butylbenzene PubChem CID: 7390 IUPAC Name: 1-tert-butyl-4-methylbenzene SMILES: CC1=CC=C(C=C1)C(C)(C)C
1-Chloro-2-iodobenzene, 99%
CAS: 615-41-8 Molecular Formula: C6H4ClI Molecular Weight (g/mol): 238.45 MDL Number: MFCD00001033 InChI Key: MPEOPBCQHNWNFB-UHFFFAOYSA-N Synonym: 2-chloroiodobenzene,o-chloroiodobenzene,o-iodochlorobenzene,2-iodochlorobenzene,benzene, 1-chloro-2-iodo,2-chlorophenyl iodide,2-chloro-1-iodobenzene,1-chloro-2-iodo-benzene,chlorjodbenzol,iodochlorobenzene PubChem CID: 11993 IUPAC Name: 1-chloro-2-iodobenzene SMILES: ClC1=CC=CC=C1I
4-(Trifluoromethyl)aniline hydrochloride, 97%
CAS: 90774-69-9 Molecular Formula: C7H7ClF3N Molecular Weight (g/mol): 197.585 MDL Number: MFCD00007897 InChI Key: CZGDYZDUMJDQSD-UHFFFAOYSA-N Synonym: 4-aminobenzotrifluoride hydrochloride,4-trifluoromethyl aniline hydrochloride,4-trifluoromethyl anilinium chloride,p-trifluoromethylaniline hydrochloride,4-trifluoromethyl phenylamine, chloride,pubchem2816,4-aminobenzotrifluoride, hydrochloride,4-trifluoromethylaniline hydrochloride,4-trifluoromethyl aniline;hydrochloride,a,a,a-trifluoro-p-toluidine hydrochloride PubChem CID: 2723961 IUPAC Name: 4-(trifluoromethyl)aniline;hydrochloride SMILES: C1=CC(=CC=C1C(F)(F)F)N.Cl
N,N-Diethyl-3-methylbenzamide, 97%
CAS: 134-62-3 Molecular Formula: C12H17NO Molecular Weight (g/mol): 191.274 MDL Number: MFCD00009046 InChI Key: MMOXZBCLCQITDF-UHFFFAOYSA-N Synonym: deet,n,n-diethyl-m-toluamide,diethyltoluamide,dieltamid,metadelphene,flypel,delphene,deta,detamide,autan PubChem CID: 4284 ChEBI: CHEBI:7071 IUPAC Name: N,N-diethyl-3-methylbenzamide SMILES: CCN(CC)C(=O)C1=CC(=CC=C1)C