Benzene and substituted derivatives
5-Chloro-2-fluorobenzoic acid, 97%, Thermo Scientific™
CAS: 394-30-9 Molecular Formula: C7H4ClFO2 Molecular Weight (g/mol): 174.56 InChI Key: WGAVMKXCDMQVNF-UHFFFAOYSA-N Synonym: 2-fluoro-5-chlorobenzoic acid,5-chloro-2-fluoro-benzoic acid,5-chloro-2-fluorobenzoicacid,benzoic acid, 5-chloro-2-fluoro,pubchem1375,acmc-1aigz,ksc223m7h,rarechem al bo 0944,5-chloro-2-fluorobenzoic acid,benzoicacid, 5-chloro-2-fluoro PubChem CID: 2736537 IUPAC Name: 5-chloro-2-fluorobenzoic acid SMILES: C1=CC(=C(C=C1Cl)C(=O)O)F
Diphenyliodonium trifluoromethanesulfonate, 99%
CAS: 66003-76-7 Molecular Formula: C12H10I·CF3O3S Molecular Weight (g/mol): 430.18 MDL Number: MFCD00191356 InChI Key: SBQIJPBUMNWUKN-UHFFFAOYSA-M Synonym: diphenyliodonium trifluoromethanesulfonate,diphenyliodanium triflate,diphenyliodonium triflate,acmc-209nt6,diphenyliodonium trifluoromethansulfonat,diphenyliodanium; trifluoromethanesulfonate,diphenyliodonium trifluoromethane sulfonate,diphenyliodonium; trifluoromethanesulfonate,diphenyliodanium; tris fluoranyl methanesulfonate PubChem CID: 2737137 IUPAC Name: diphenyliodanium;trifluoromethanesulfonate SMILES: C1=CC=C(C=C1)[I+]C2=CC=CC=C2.C(F)(F)(F)S(=O)(=O)[O-]
2-(Diphenylphosphino)benzaldehyde, 97%
CAS: 50777-76-9 Molecular Formula: C19H15OP Molecular Weight (g/mol): 290.30 MDL Number: MFCD00013367 InChI Key: DRCPJRZHAJMWOU-UHFFFAOYSA-N Synonym: 2-diphenylphosphino benzaldehyde,2-diphenylphosphinobenzaldehyde,o-diphenylphosphino benzaldehyde,2-formylphenyl diphenylphosphine,2-diphenylphosphanyl benzaldehyde,benzaldehyde, 2-diphenylphosphino,dppbde,zlchem 984,2-formylphenyldiphenylphosphine PubChem CID: 2754316 IUPAC Name: 2-diphenylphosphanylbenzaldehyde SMILES: O=CC1=CC=CC=C1P(C1=CC=CC=C1)C1=CC=CC=C1
Diiodobis(triphenylphosphine)nickel(II)
CAS: 82308-17-6 Molecular Formula: C36H30I2NiP2 Molecular Weight (g/mol): 837.09 MDL Number: MFCD00015866 InChI Key: CRLSSYRKSIEFOQ-UHFFFAOYSA-L Synonym: diiododbis triphenylphosphinenickel ii,diiodobis triphenylphosphine nickel ii,nii2 pph3 2,diiodonickel; triphenylphosphane PubChem CID: 6102125 IUPAC Name: diiodonickel;triphenylphosphane SMILES: I[Ni++]I.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
(S)-(-)-2-Methyl-CBS-oxazaborolidine, 1M solution in toluene, Thermo Scientific Chemicals
CAS: 112022-81-8 Molecular Formula: C18H20BNO Molecular Weight (g/mol): 277.17 MDL Number: MFCD00078439 InChI Key: VMKAFJQFKBASMU-KRWDZBQOSA-N Synonym: s-2-methyl-cbs-oxazaborolidine,s-methyl oxazaborolidine,s---2-methyl-cbs-oxazaborolidine,s-5,5-diphenyl-2-methyl-3,4-propano-1,3,2-oxazaborolidine,corey catalyst,s-methyl-cbs-oxazaborolidine,s-3,3-diphenyl-1-methylpyrrolidino 1,2-c-1,3,2-oxazaborole,s-me-cbs catalyst,s-methyl-cbs,s-me-cbs PubChem CID: 2734713 IUPAC Name: (3aS)-1-methyl-3,3-diphenyl-3a,4,5,6-tetrahydropyrrolo[1,2-c][1,3,2]oxazaborole SMILES: [H][C@@]12CCCN1B(C)OC2(C1=CC=CC=C1)C1=CC=CC=C1
4-(N-BOC-amino)phenylboronic acid, 97%
CAS: 380430-49-9 Molecular Formula: C11H16BNO4 Molecular Weight (g/mol): 237.06 MDL Number: MFCD02093054 InChI Key: UBVOLHQIEQVXGM-UHFFFAOYSA-N Synonym: 4-boc-aminophenyl boronic acid,4-n-boc-amino phenylboronic acid,4-tert-butoxycarbonyl amino phenyl boronic acid,4-tert-butoxycarbonylamino phenylboronic acid,4-tert-butoxycarbonyl aminophenylboronic acid,4-boc-amino benzeneboronic acid,4-aminobenzeneboronic acid, n-boc protected,4-tert-butoxycarbonyl amino phenylboronic acid,4-2-methylpropan-2-yl oxycarbonylamino phenyl boronic acid,4-tert-butoxycarbonylamino phenyl boronic acid PubChem CID: 3613184 IUPAC Name: [4-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]boronic acid SMILES: CC(C)(C)OC(=O)NC1=CC=C(C=C1)B(O)O
4-Fluoro-3-methylphenylboronic acid, 98%
CAS: 139911-27-6 Molecular Formula: C7H8BFO2 Molecular Weight (g/mol): 153.95 MDL Number: MFCD01863527 InChI Key: JCIJCHSRVPSOML-UHFFFAOYSA-N Synonym: 3-methyl-4-fluorophenylboronic acid,4-fluoro-3-methylphenyl boronic acid,4-fluoro-3-methylbenzeneboronic acid,4-fluoro-m-tolylboronic acid,4-fluoro-3-methylphenylboronicacid,5-borono-2-fluorotoluene,boronic acid, 4-fluoro-3-methylphenyl,pubchem5146,acmc-209cjo PubChem CID: 2774580 IUPAC Name: (4-fluoro-3-methylphenyl)boronic acid SMILES: CC1=CC(=CC=C1F)B(O)O
4-Dimethylaminobenzaldehyde, 98%, Thermo Scientific Chemicals
CAS: 100-10-7 Molecular Formula: C9H11NO Molecular Weight (g/mol): 149.19 MDL Number: MFCD00003381 InChI Key: BGNGWHSBYQYVRX-UHFFFAOYSA-N Synonym: 4-dimethylamino benzaldehyde,p-dimethylaminobenzaldehyde,ehrlich's reagent,p-formyldimethylaniline,benzaldehyde, 4-dimethylamino,p-dimethylamino benzaldehyde,p-formyl-n,n-dimethylaniline,n,n-dimethyl-p-aminobenzaldehyde,p-n,n-dimethylamino benzaldehyde,4-dimethylaminobenzenecarbonal PubChem CID: 7479 IUPAC Name: 4-(dimethylamino)benzaldehyde SMILES: CN(C)C1=CC=C(C=O)C=C1
(+/-)-Atenolol
CAS: 29122-68-7 Molecular Formula: C14H22N2O3 Molecular Weight (g/mol): 266.341 MDL Number: MFCD00057645 InChI Key: METKIMKYRPQLGS-UHFFFAOYSA-N Synonym: atenolol,tenormin,tenormine,normiten,blokium,prenormine,tenoblock,atehexal,betablok,cuxanorm PubChem CID: 2249 ChEBI: CHEBI:2904 IUPAC Name: 2-[4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl]acetamide SMILES: CC(C)NCC(COC1=CC=C(C=C1)CC(=O)N)O
Methyl 4-amino-3-bromobenzoate, 97%
CAS: 106896-49-5 Molecular Formula: C8H8BrNO2 Molecular Weight (g/mol): 230.06 MDL Number: MFCD01861385 InChI Key: AIUWAOALZYWQBX-UHFFFAOYSA-N Synonym: 4-amino-3-bromo-benzoic acid methyl ester,methyl4-amino-3-bromobenzoate,2-bromo-4-methoxycarbonylaniline,benzoic acid, 4-amino-3-bromo-, methyl ester,4-amino-3-bromobenzoic acid methyl ester,acmc-2098mp,methyl-4-amino-3-bromobenzoate,methyl 4-amino-3-bromo-benzoate,timtec-bb sbb012847,2-bromo-4-methoxycarbonyl aniline PubChem CID: 1515280 IUPAC Name: methyl 4-amino-3-bromobenzoate SMILES: COC(=O)C1=CC=C(N)C(Br)=C1
4,5-Dimethoxy-2-nitrobenzyl chloroformate, 97%
CAS: 42855-00-5 Molecular Formula: C10H10ClNO6 Molecular Weight (g/mol): 275.641 MDL Number: MFCD00143507 InChI Key: RWWPKIOWBQFXEE-UHFFFAOYSA-N Synonym: 4,5-dimethoxy-2-nitrobenzyl carbonochloridate,nvoc-cl,4,5-dimethoxy-2-nitrobenzyl chloroformate,6-nitroveratryl chloroformate,nitroveratryl oxy chlorocarbamate,6-nitroveratryloxycarbonyl chloride,carbonochloridic acid, 4,5-dimethoxy-2-nitrophenyl methyl ester,4,5-dimethoxy-2-nitrophenyl methyl chloroformate,4,5-dimethoxy-2-nitrophenyl methyl carbonochloridate,nvoc chloride PubChem CID: 3084878 IUPAC Name: (4,5-dimethoxy-2-nitrophenyl)methyl carbonochloridate SMILES: COC1=C(C=C(C(=C1)COC(=O)Cl)[N+](=O)[O-])OC
4-(Boc-amino)benzeneboronic acid pinacol ester, 97%
CAS: 330793-01-6 Molecular Formula: C17H26BNO4 Molecular Weight (g/mol): 319.21 MDL Number: MFCD02179439 InChI Key: HSJNIOYPTSKQBD-UHFFFAOYSA-N Synonym: 4-n-boc-amino phenylboronic acid pinacol ester,tert-butyl 4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl phenyl carbamate,4-boc-amino benzeneboronic acid pinacol ester,tert-butyl n-4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl phenyl carbamate,4-boc-amino phenylboronic acid pinacol cyclic ester,4-boc-aminophenylboronic acid, pinacol ester,4-tert-butoxycarbonyl aminophenylboronic acid, pinacol ester,tert-butyl n-4-tetramethyl-1,3,2-dioxaborolan-2-yl phenyl carbamate,tert-butyl 4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl phenylcarbamate PubChem CID: 2734617 IUPAC Name: tert-butyl N-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]carbamate SMILES: CC(C)(C)OC(=O)NC1=CC=C(C=C1)B1OC(C)(C)C(C)(C)O1
1-Benzyloxy-3-iodobenzene, 99%
CAS: 107623-21-2 Molecular Formula: C13H11IO Molecular Weight (g/mol): 310.13 MDL Number: MFCD01318100 InChI Key: QMKHOPJXDQAHBG-UHFFFAOYSA-N Synonym: 1-benzyloxy-3-iodobenzene,3-iodobenzyloxybenzene,1-benzyloxy-3-iodo-benzene,benzene,1-iodo-3-phenylmethoxy,benzene, 1-iodo-3-phenylmethoxy,pubchem3066,3-benzyloxyiodobenzene,acmc-1c7zz,1-benzyl-oxy-3-iodobenzene PubChem CID: 4228019 IUPAC Name: 1-iodo-3-phenylmethoxybenzene SMILES: IC1=CC=CC(OCC2=CC=CC=C2)=C1
2-Bromobenzonitrile, 99%
CAS: 2042-37-7 Molecular Formula: C7H4BrN Molecular Weight (g/mol): 182.02 MDL Number: MFCD00001772 InChI Key: AFMPMSCZPVNPEM-UHFFFAOYSA-N Synonym: o-bromobenzonitrile,1-bromo-2-cyanobenzene,benzonitrile, 2-bromo,benzonitrile, o-bromo,2-bromobenzenecarbonitrile,o-bromocyanobenzene,2-cyanobromobenzene,2-bromo-benzonitrile,bromobenzonitrile 2-,bromobenzonitrile PubChem CID: 16272 IUPAC Name: 2-bromobenzonitrile SMILES: BrC1=CC=CC=C1C#N
3-Chloro-4-fluoro-5-nitrobenzotrifluoride, 98%, Thermo Scientific Chemicals
CAS: 101646-02-0 Molecular Formula: C7H2ClF4NO2 Molecular Weight (g/mol): 243.54 MDL Number: MFCD00674108 InChI Key: JVOKKJHIEVEFEB-UHFFFAOYSA-N Synonym: 3-chloro-4-fluoro-5-nitrobenzotrifluoride,1-chloro-2-fluoro-3-nitro-5-trifluoromethyl benzene,3-chloro-2-fluoro-1-nitro-5-trifluoromethyl benzene,5-chloro-4-fluoro-3-nitrotrifluoromethylbenzene,5-chloro-4-fluoro-3-nitro-trifluoromethylbenzene PubChem CID: 2736565 IUPAC Name: 1-chloro-2-fluoro-3-nitro-5-(trifluoromethyl)benzene SMILES: [O-][N+](=O)C1=C(F)C(Cl)=CC(=C1)C(F)(F)F