Benzenoids
2-Bromo-3-fluorobenzaldehyde, 98%
CAS: 891180-59-9 Molecular Formula: C7H4BrFO Molecular Weight (g/mol): 203.01 MDL Number: MFCD07782044 InChI Key: CYJBMGYWRHGZBR-UHFFFAOYSA-N Synonym: 2-bromo-3-fluoro-benzaldehyde,benzaldehyde, 2-bromo-3-fluoro,pubchem1417,pubchem22500,acmc-1bwut,ksc494e8j,6-fluoro-2-formylbromobenzene PubChem CID: 24820504 IUPAC Name: 2-bromo-3-fluorobenzaldehyde SMILES: C1=CC(=C(C(=C1)F)Br)C=O
4-Aminobenzyl alcohol, 98%
CAS: 623-04-1 Molecular Formula: C7H9NO Molecular Weight (g/mol): 123.16 MDL Number: MFCD00014782 InChI Key: AXKGIPZJYUNAIW-UHFFFAOYSA-N Synonym: 4-aminobenzyl alcohol,4-aminophenyl methanol,4-aminobenzylalcohol,4-hydroxymethyl aniline,p-aminobenzyl alcohol,p-aminobenzylalcohol,benzenemethanol, 4-amino,benzyl alcohol, p-amino,4-amino-benzylalcohol,pubchem7480 PubChem CID: 69331 IUPAC Name: (4-aminophenyl)methanol SMILES: NC1=CC=C(CO)C=C1
2-Methylbenzylamine, 98%
CAS: 89-93-0 Molecular Formula: C8H11N Molecular Weight (g/mol): 121.183 MDL Number: MFCD00008112 InChI Key: CJAAPVQEZPAQNI-UHFFFAOYSA-N Synonym: 2-methylbenzylamine,o-tolylmethanamine,o-methylbenzylamine,benzenemethanamine, 2-methyl,o-xylylamine,benzylamine, o-methyl,2-methylphenyl methanamine,alpha-amino-o-xylene,alpha-amino-2-xylene,1-2-methylphenyl methanamine PubChem CID: 6993 IUPAC Name: (2-methylphenyl)methanamine SMILES: CC1=CC=CC=C1CN
1-(2,6-Difluorophenyl)ethanol, 97%, Thermo Scientific Chemicals
CAS: 87327-65-9 Molecular Formula: C8H8F2O Molecular Weight (g/mol): 158.15 MDL Number: MFCD00274321 InChI Key: SIYWDKQSSDBLOA-UHFFFAOYNA-N Synonym: 1-2,6-difluorophenyl ethanol,1-2,6-difluorophenyl ethan-1-ol,2,6-difluoro-alpha-methylbenzyl alcohol,benzenemethanol,2,6-difluoro-a-methyl,2,6-difluoro-.alpha.-methylbenzyl alcohol PubChem CID: 5012075 IUPAC Name: 1-(2,6-difluorophenyl)ethanol SMILES: CC(O)C1=C(F)C=CC=C1F
1-(4-Chlorophenyl)-1-methylethylamine, 97%
CAS: 17797-11-4 Molecular Formula: C9H12ClN Molecular Weight (g/mol): 169.65 MDL Number: MFCD08669636 InChI Key: JCUUNSQUTQELEZ-UHFFFAOYSA-N Synonym: 2-4-chlorophenyl propan-2-amine,1-4-chlorophenyl-1-methylethylamine,2-4-chlorophenyl prop-2-ylamine,4-chloro-alpha,alpha-dimethylbenzylamine,4-chlorocumylamine,alpha-amino-4-chlorocumene,2-4-chlorophenyl-2-propanamine,2-?4-chlorophenyl?propan-2-amine,benzenemethanamine,4-chloro-,a,,a-dimethyl,benzenemethanamine,4-chloro-a,a-dimethyl PubChem CID: 11030256 IUPAC Name: 2-(4-chlorophenyl)propan-2-amine SMILES: CC(C)(N)C1=CC=C(Cl)C=C1
3-Methylbenzoic anhydride, 97%
CAS: 21436-44-2 Molecular Formula: C16H14O3 Molecular Weight (g/mol): 254.285 MDL Number: MFCD00048083 InChI Key: DGZSQLHPEZFGSI-UHFFFAOYSA-N Synonym: 3-methylbenzoic anhydride,m-toluic anhydride,3-methylbenzene-1-carboxylic anhydride,benzoic acid, 3-methyl-, anhydride,3-methylbenzene-1-carboxylicanhydride,3-methylbenzoicanhydride,bis 3-methylbenzoic acid anhydride,3-methylbenzoyl 3-methylbenzoate,benzoic acid,3-methyl-, 1,1'-anhydride PubChem CID: 253301 IUPAC Name: (3-methylbenzoyl) 3-methylbenzoate SMILES: CC1=CC=CC(=C1)C(=O)OC(=O)C2=CC(=CC=C2)C
N-Fmoc-L-beta-homoproline, 95%
CAS: 193693-60-6 Molecular Formula: C21H21NO4 Molecular Weight (g/mol): 351.402 MDL Number: MFCD01863058 InChI Key: ZNIGOUDZWCDFFC-AWEZNQCLSA-N Synonym: fmoc-l-beta-homoproline,fmoc-beta-hopro-oh,s-2-1-9h-fluoren-9-yl methoxy carbonyl pyrrolidin-2-yl acetic acid,2s-1-9h-fluoren-9-ylmethoxy carbonyl pyrrolidin-2-yl acetic acid,2-2s-1-9h-fluoren-9-ylmethoxycarbonyl pyrrolidin-2-yl acetic acid,fmoc-d-beta-homoproline,fmoc-hopro-oh,fmoc-beta-homopro-oh,fmoc-l-beta-hpro-oh,fmoc-i 2-hopro-oh PubChem CID: 2761542 IUPAC Name: 2-[(2S)-1-(9H-fluoren-9-ylmethoxycarbonyl)pyrrolidin-2-yl]acetic acid SMILES: C1CC(N(C1)C(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24)CC(=O)O
2-Bromo-4-(trifluoromethyl)phenylacetonitrile, 98%
CAS: 474024-36-7 Molecular Formula: C9H5BrF3N Molecular Weight (g/mol): 264.05 MDL Number: MFCD03094308 InChI Key: RYUZTTSDBHOIAF-UHFFFAOYSA-N PubChem CID: 2778436 IUPAC Name: 2-[2-bromo-4-(trifluoromethyl)phenyl]acetonitrile SMILES: FC(F)(F)C1=CC(Br)=C(CC#N)C=C1
3-(Dimethylsulfamoyl)benzeneboronic acid, 98%
CAS: 871329-59-8 Molecular Formula: C8H12BNO4S Molecular Weight (g/mol): 229.057 MDL Number: MFCD07363747 InChI Key: SGERXKCDWJPIOS-UHFFFAOYSA-N Synonym: 3-n,n-dimethylsulfamoyl phenyl boronic acid,n,n-dimethyl 3-boronobenzenesulfonamide,3-dimethylsulfamoyl phenyl boronic acid,3-n,n-dimethylsulphonamido benzeneboronic acid,3-dimethylsulfamoyl phenylboronic acid,3-dimethylsulfamoyl benzeneboronic acid,3-n,n-dimethylsulfonamidophenyl boronic acid,boronic acid, 3-dimethylamino sulfonyl phenyl,boronic acid,b-3-dimethylamino sulfonyl phenyl,acmc-209qg4 PubChem CID: 44119634 IUPAC Name: [3-(dimethylsulfamoyl)phenyl]boronic acid SMILES: B(C1=CC(=CC=C1)S(=O)(=O)N(C)C)(O)O
4-Methoxycarbonyl-2-nitrobenzeneboronic acid, 97%
CAS: 85107-55-7 Molecular Formula: C8H8BNO6 Molecular Weight (g/mol): 224.963 MDL Number: MFCD01632202 InChI Key: SFEJGHJCGQNFQC-UHFFFAOYSA-N Synonym: 4-methoxycarbonyl-2-nitrophenyl boronic acid,4-methoxycarbonyl-2-nitrophenylboronic acid,4-methoxycarbonyl-2-nitrobenzeneboronic acid,methyl 4-dihydroxyboranyl-3-nitrobenzoate,2-nitro-4-methoxycarbonyl phenylboronic acid,4-methoxycarbonyl-2-nitro-phenyl boronic acid,methyl 4-borono-3-nitrobenzoate,acmc-209q4d PubChem CID: 2773493 IUPAC Name: (4-methoxycarbonyl-2-nitrophenyl)boronic acid SMILES: B(C1=C(C=C(C=C1)C(=O)OC)[N+](=O)[O-])(O)O
3,5-Dibromoanisole, 97%, Thermo Scientific Chemicals
CAS: 74137-36-3 Molecular Formula: C7H6Br2O Molecular Weight (g/mol): 265.932 MDL Number: MFCD02258848 InChI Key: OQZAQBGJENJMHT-UHFFFAOYSA-N Synonym: 3,5-dibromoanisole,1,3-dibromo-5-methoxy-benzene,benzene, 1,3-dibromo-5-methoxy,pubchem2009,acmc-1bh5r,ksc493q1d,1.3-dibromo-5-methoxybenzene PubChem CID: 11021812 IUPAC Name: 1,3-dibromo-5-methoxybenzene SMILES: COC1=CC(=CC(=C1)Br)Br
N-Boc-4-bromo-3-fluoroaniline, 96%, Thermo Scientific Chemicals
CAS: 868735-43-7 Molecular Formula: C11H13BrFNO2 Molecular Weight (g/mol): 290.132 MDL Number: MFCD11976284 InChI Key: FQLYUJLJZFATNI-UHFFFAOYSA-N Synonym: tert-butyl 4-bromo-3-fluorophenyl carbamate,tert-butyl n-4-bromo-3-fluorophenyl carbamate,tert-butyl 4-bromo-3-fluorophenylcarbamate,4-bromo-3-fluoro-phenyl-carbamic acid tert-butyl ester,n-boc-4-bromo-3-fluoroaniline PubChem CID: 59852943 IUPAC Name: tert-butyl N-(4-bromo-3-fluorophenyl)carbamate SMILES: CC(C)(C)OC(=O)NC1=CC(=C(C=C1)Br)F
2,5-Difluorobenzene-1,4-diboronic acid bis(pinacol) ester, 96%
CAS: 303006-90-8 Molecular Formula: C18H26B2F2O4 Molecular Weight (g/mol): 366.019 MDL Number: MFCD12407211 InChI Key: PJCSUAIUPWCQRS-UHFFFAOYSA-N Synonym: 2,2'-2,5-difluoro-1,4-phenylene bis 4,4,5,5-tetramethyl-1,3,2-dioxaborolane,2,5-difluoro-1,4-phenylenediboronic acid, pinacol ester,2-2,5-difluoro-4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl phenyl-4,4,5,5-tetramethyl-1,3,2-dioxaborolane,2,5-difluoro-1,4-phenylenediboronic acid,pinacol ester,2,2'-2,5-difluoro-p-phenylene bis 4,4,5,5-tetramethyl-1,3,2-dioxaborolane,2,2-2,5-difluoro-1,4-phenylene bis 4,4,5,5-tetramethyl-1,3,2-dioxaborolane PubChem CID: 53216814 IUPAC Name: 2-[2,5-difluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane SMILES: B1(OC(C(O1)(C)C)(C)C)C2=CC(=C(C=C2F)B3OC(C(O3)(C)C)(C)C)F
tert-Butyl phenyl carbonate, 97%
CAS: 6627-89-0 Molecular Formula: C11H14O3 Molecular Weight (g/mol): 194.23 MDL Number: MFCD00008804 InChI Key: UXWVQHXKKOGTSY-UHFFFAOYSA-N Synonym: t-butyl phenyl carbonate,tert-butylphenylcarbonate,2-methyl-2-propanyl phenyl carbonate,carbonic acid, 1,1-dimethylethyl phenyl ester,pubchem13300,acmc-209nuo,phenyl t-butyl carbonate,uxwvqhxkkogtsy-uhfffaoysa,tert-butyl phenyl carbonate,carbonic acid tert-butylphenyl ester PubChem CID: 81113 IUPAC Name: tert-butyl phenyl carbonate SMILES: CC(C)(C)OC(=O)OC1=CC=CC=C1
Methyl 2-bromo-3-methylbenzoate, 98%
CAS: 131001-86-0 Molecular Formula: C9H9BrO2 Molecular Weight (g/mol): 229.07 MDL Number: MFCD00144762 InChI Key: QAOFGUXVDAZKBW-UHFFFAOYSA-N Synonym: 2-bromo-3-methyl-benzoic acid methyl ester,methyl2-bromo-3-methylbenzoate,benzoic acid, 2-bromo-3-methyl-, methyl ester,2-bromo-3-methylbenzoic acid methyl ester,methyl 2-bromo-3-methyl-benzoate,pubchem3966,acmc-1c3gk,methyl 2-bromo-m-toluate,intermediates-zcf02010,ksc495c9h PubChem CID: 10823279 IUPAC Name: methyl 2-bromo-3-methylbenzoate SMILES: COC(=O)C1=C(Br)C(C)=CC=C1