Benzene and substituted derivatives
1-(Mesitylene-2-sulfonyl)-3-nitro-1,2,4-triazole, 98%
CAS: 74257-00-4 Molecular Formula: C11H12N4O4S Molecular Weight (g/mol): 296.30 MDL Number: MFCD00009754 InChI Key: SFYDWLYPIXHPML-UHFFFAOYSA-N Synonym: 1-mesitylsulfonyl-3-nitro-1h-1,2,4-triazole,1-mesitylene-2-sulfonyl-3-nitro-1,2,4-triazole,msnt,1-mesitylene-2-sulfonyl-3-nitro-1h-1,2,4-triazole,3-nitro-1-2,4,6-trimethylphenyl sulfonyl-1,2,4-triazole,1-2-mesitylenesulfonyl-3-nitro-1h-1,2,4-triazole,2,4,6-trimethylphenyl-3-nitro-1,2,4-triazol-1-yl sulfone,3-nitro-1-2,4,6-trimethylbenzenesulfonyl-1h-1,2,4-triazole,1h-1,2,4-triazole, 3-nitro-1-2,4,6-trimethylphenyl sulfonyl PubChem CID: 716901 IUPAC Name: 3-nitro-1-(2,4,6-trimethylphenyl)sulfonyl-1,2,4-triazole SMILES: CC1=CC(C)=C(C(C)=C1)S(=O)(=O)N1C=NC(=N1)[N+]([O-])=O
Tetrakis(triphenylphosphine)nickel(0), Thermo Scientific Chemicals
CAS: 15133-82-1 Molecular Formula: C72H60NiP4 Molecular Weight (g/mol): 1107.86 MDL Number: MFCD00010011 InChI Key: KFBKRCXOTTUAFS-UHFFFAOYSA-N Synonym: ni pph3 4,tetrakis triphenylphosphine nickel,tetrakis triphenylphosphine nickel 0,nickel-tetrakis triphenylphosphine,tetrakis triphenylphosphine nickel 0 , ni 4-7 % approx. PubChem CID: 11979963 IUPAC Name: nickel;triphenylphosphane SMILES: [Ni].C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=CC=C1.C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=CC=C1.C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=CC=C1.C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=CC=C1
3,3',4,4'-Benzophenonetetracarboxylic dianhydride, 97+%
CAS: 2421-28-5 Molecular Formula: C17H6O7 Molecular Weight (g/mol): 322.228 MDL Number: MFCD00005923 InChI Key: VQVIHDPBMFABCQ-UHFFFAOYSA-N Synonym: 3,3',4,4'-benzophenonetetracarboxylic dianhydride,benzophenonetetracarboxylic dianhydride,benzophenonetetracarboxylic acid dianhydride,1,3-isobenzofurandione, 5,5'-carbonylbis,4,4'-carbonylbis phthalic anhydride,4,4'-carbonyldiphthalic anhydride,4,4'-diphthalic anhydride ketone,benzophenonetetracarboxylic anhydride,phthalic anhydride, 4,4'-carbonyldi,unii-y61gva8097 PubChem CID: 75498 IUPAC Name: 5-(1,3-dioxo-2-benzofuran-5-carbonyl)-2-benzofuran-1,3-dione SMILES: C1=CC2=C(C=C1C(=O)C3=CC4=C(C=C3)C(=O)OC4=O)C(=O)OC2=O
Thermo Scientific Chemicals Fluconazole, 98%
CAS: 86386-73-4 Molecular Formula: C13H12F2N6O Molecular Weight (g/mol): 306.27 InChI Key: RFHAOTPXVQNOHP-UHFFFAOYSA-N Synonym: fluconazole,diflucan,triflucan,elazor,biozolene,biocanol,fungata,fluconazol,fluconazolum,flucazol PubChem CID: 3365 ChEBI: CHEBI:46081 IUPAC Name: 2-(2,4-difluorophenyl)-1,3-bis(1,2,4-triazol-1-yl)propan-2-ol SMILES: C1=CC(=C(C=C1F)F)C(CN2C=NC=N2)(CN3C=NC=N3)O
Thermo Scientific Chemicals Anastrozole, 98%
CAS: 120511-73-1 Molecular Formula: C17H19N5 Molecular Weight (g/mol): 293.37 InChI Key: YBBLVLTVTVSKRW-UHFFFAOYSA-N Synonym: anastrozole,arimidex,anastrazole,anastrozol,2,2'-5-1h-1,2,4-triazol-1-yl methyl-1,3-phenylene bis 2-methylpropanenitrile,anastrole,asiolex,zeneca zd 1033,unii-2z07myw1az,arimidex tn PubChem CID: 2187 ChEBI: CHEBI:2704 IUPAC Name: 2-[3-(2-cyanopropan-2-yl)-5-(1,2,4-triazol-1-ylmethyl)phenyl]-2-methylpropanenitrile SMILES: CC(C)(C#N)C1=CC(=CC(=C1)CN2C=NC=N2)C(C)(C)C#N
1-Bromo-2,4-dinitrobenzene, MP Biomedicals
CAS: 584-48-5 Molecular Formula: C6H3BrN2O4 Molecular Weight (g/mol): 247.004 InChI Key: PBOPJYORIDJAFE-UHFFFAOYSA-N Synonym: 2,4-dinitrobromobenzene,4-bromo-1,3-dinitrobenzene,o,p-dinitrophenyl bromide,2,4-dinitrophenyl bromide,dnbb,benzene, 1-bromo-2,4-dinitro,2, 4-dinitrobromobenzene,1-bromo-2,4-dinitrobenze,unii-4ms3ftw380,ccris 1801 PubChem CID: 11441 ChEBI: CHEBI:58999 IUPAC Name: 1-bromo-2,4-dinitrobenzene SMILES: C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])Br
m-Bromotoluene, MP Biomedicals
CAS: 591-17-3 Molecular Formula: C7H7Br Molecular Weight (g/mol): 171.04 MDL Number: MFCD00000085 InChI Key: WJIFKOVZNJTSGO-UHFFFAOYSA-N Synonym: 3-bromotoluene,m-bromotoluene,3-methylbromobenzene,benzene, 1-bromo-3-methyl,m-tolyl bromide,toluene, m-bromo,5-bromotoluene,3-bromo-1-methylbenzene,m-methylbromobenzene,3-methyl-1-bromobenzene PubChem CID: 11560 IUPAC Name: 1-bromo-3-methylbenzene SMILES: CC1=CC=CC(Br)=C1
4-Bromobenzoyl chloride, 98+%
CAS: 586-75-4 Molecular Formula: C7H4BrClO Molecular Weight (g/mol): 219.46 MDL Number: MFCD00000683 InChI Key: DENKGPBHLYFNGK-UHFFFAOYSA-N Synonym: p-bromobenzoyl chloride,benzoyl chloride, 4-bromo,benzoyl chloride, p-bromo,4-bromobenzoylchloride,p-bromobenzoyl chloride, p-bromo,4-bromobenzoic acid chloride,p-brombenzoylchlorid,4bromobenzoyl chloride,p-brc6h4cocl,4-bromo-benzoylchloride PubChem CID: 68515 IUPAC Name: 4-bromobenzoyl chloride SMILES: ClC(=O)C1=CC=C(Br)C=C1
1-Phenoxy-2-propanol, tech. 85%
CAS: 770-35-4 Molecular Formula: C9H12O2 Molecular Weight (g/mol): 152.19 MDL Number: MFCD00016861 InChI Key: IBLKWZIFZMJLFL-UHFFFAOYNA-N Synonym: 1-phenoxy-2-propanol,2-propanol, 1-phenoxy,phenoxyisopropanol,propylene phenoxetol,2-phenoxy-1-methylethanol,1-phenoxy-propan-2-ol,phenyl-.beta.-hydroxypropyl ether,dsstox_cid_7312,dsstox_rid_78402,dsstox_gsid_27312 PubChem CID: 92839 IUPAC Name: 1-phenoxypropan-2-ol SMILES: CC(O)COC1=CC=CC=C1
2-Nitro-m-xylene, 99%
CAS: 81-20-9 Molecular Formula: C8H9NO2 Molecular Weight (g/mol): 151.165 MDL Number: MFCD00007181 InChI Key: HDFQKJQEWGVKCQ-UHFFFAOYSA-N Synonym: 2-nitro-m-xylene,2,6-dimethylnitrobenzene,benzene, 1,3-dimethyl-2-nitro,2,6-dimethyl-1-nitrobenzene,m-xylene, 2-nitro,ccris 3119,1,3-dimethyl-2-nitro-benzene,dsstox_cid_5134,dsstox_rid_77678,dsstox_gsid_25134 PubChem CID: 6672 IUPAC Name: 1,3-dimethyl-2-nitrobenzene SMILES: CC1=C(C(=CC=C1)C)[N+](=O)[O-]
2-tert-Butylphenol, 99%
CAS: 88-18-6 Molecular Formula: C10H14O Molecular Weight (g/mol): 150.221 MDL Number: MFCD00002223 InChI Key: WJQOZHYUIDYNHM-UHFFFAOYSA-N Synonym: 2-tert-butyl phenol,2-t-butylphenol,phenol, 2-1,1-dimethylethyl,phenol, o-tert-butyl,o-t-butylphenol,o-tert-butylphenol,tert-butylphenol,2-1,1-dimethylethyl phenol,2-tert-butyl-1-hydroxybenzene,t-butylphenol PubChem CID: 6923 ChEBI: CHEBI:34305 IUPAC Name: 2-tert-butylphenol SMILES: CC(C)(C)C1=CC=CC=C1O
3,5-Bis(trifluoromethyl)phenyl isocyanate, 98%
CAS: 16588-74-2 Molecular Formula: C9H3F6NO Molecular Weight (g/mol): 255.119 MDL Number: MFCD00013559 InChI Key: NRSSOFNMWSJECS-UHFFFAOYSA-N Synonym: 3,5-bis trifluoromethyl phenylisocyanate,3,5-bis trifluoromethyl phenyl isocyanate,1-isocyanato-3,5-bis trifluoromethyl benzene,3,5-bis trifluoromethyl isocyanate,3,5-di trifluoromethyl phenyl isocyanate,3,5-di trifluoromethyl phenylisocyanate,3,5-bis trifluoromethyl benzenisocyanate,pubchem2735,acmc-209dtj,3,5-bistrifluorometylphenylisocyanate PubChem CID: 2733314 IUPAC Name: 1-isocyanato-3,5-bis(trifluoromethyl)benzene SMILES: C1=C(C=C(C=C1C(F)(F)F)N=C=O)C(F)(F)F
p-Toluenesulfonyl fluoride, 98%
CAS: 455-16-3 Molecular Formula: C7H7FO2S Molecular Weight (g/mol): 174.189 MDL Number: MFCD00007421 InChI Key: IZZYABADQVQHLC-UHFFFAOYSA-N Synonym: p-toluenesulfonyl fluoride,tosyl fluoride,4-toluenesulfonyl fluoride,benzenesulfonyl fluoride, 4-methyl,4-tolylsulfonyl fluoride,toluene-4-sulfonyl fluoride,p-methylbenzenesulfonyl fluoride,p-toluenesulphonyl fluoride,toluene-p-sulphonyl fluoride,p-methylphenylsulfonyl fluoride PubChem CID: 9965 IUPAC Name: 4-methylbenzenesulfonyl fluoride SMILES: CC1=CC=C(C=C1)S(=O)(=O)F
2-Chlorobenzaldehyde, 99%
CAS: 89-98-5 Molecular Formula: C7H5ClO Molecular Weight (g/mol): 140.57 MDL Number: MFCD00003304 InChI Key: FPYUJUBAXZAQNL-UHFFFAOYSA-N Synonym: o-chlorobenzaldehyde,chlorobenzaldehyde,benzaldehyde, 2-chloro,benzaldehyde, o-chloro,2-chlorbenzaldehyd,2-clorobenzaldeide,o-chloorbenzaldehyde,usaf m-7,2-chloorbenzaldehyde,o-chlorobenzenecarboxaldehyde PubChem CID: 6996 IUPAC Name: 2-chlorobenzaldehyde SMILES: C1=CC=C(C(=C1)C=O)Cl
1,2-Difluorobenzene, 98%
CAS: 367-11-3 Molecular Formula: C6H4F2 Molecular Weight (g/mol): 114.10 MDL Number: MFCD00000284 InChI Key: GOYDNIKZWGIXJT-UHFFFAOYSA-N Synonym: o-difluorobenzene,benzene, 1,2-difluoro,benzene, o-difluoro,ortho-difluorobenzene,o-difluoro benzene,difluorobenzene,1,2-difluoro-benzene,unii-aw7qgmw29c,aw7qgmw29c,0-difluorobenzene PubChem CID: 9706 ChEBI: CHEBI:38583 IUPAC Name: 1,2-difluorobenzene SMILES: FC1=CC=CC=C1F