Benzenoids
Tamsulosin hydrochloride, 98+%
CAS: 106463-17-6 Molecular Formula: C20H29ClN2O5S Molecular Weight (g/mol): 444.971 MDL Number: MFCD00922997 InChI Key: ZZIZZTHXZRDOFM-XFULWGLBSA-N Synonym: tamsulosin hydrochloride,omnic,tamsulosin hcl,pradif,flomax,urolosin,secotex,josir,alna,omic PubChem CID: 5362376 ChEBI: CHEBI:9399 IUPAC Name: 5-[(2R)-2-[2-(2-ethoxyphenoxy)ethylamino]propyl]-2-methoxybenzenesulfonamide;hydrochloride SMILES: CCOC1=CC=CC=C1OCCNC(C)CC2=CC(=C(C=C2)OC)S(=O)(=O)N.Cl
p-Xylylenediamine, 97%
CAS: 539-48-0 Molecular Formula: C8H12N2 Molecular Weight (g/mol): 136.198 MDL Number: MFCD00009821 InChI Key: ISKQADXMHQSTHK-UHFFFAOYSA-N Synonym: p-xylylenediamine,1,4-phenylenedimethanamine,1,4-bis aminomethyl benzene,1,4-benzenedimethanamine,1,4-xylylenediamine,p-xylylendiamine,4-aminomethylbenzylamine,p-xylylendiamine czech,p-phenylenebis methylamine,4-aminomethyl phenyl methanamine PubChem CID: 68315 IUPAC Name: [4-(aminomethyl)phenyl]methanamine SMILES: C1=CC(=CC=C1CN)CN
Phenylglyoxylic acid, 98%
CAS: 611-73-4 Molecular Formula: C8H6O3 Molecular Weight (g/mol): 150.13 MDL Number: MFCD00002575 InChI Key: FAQJJMHZNSSFSM-UHFFFAOYSA-N Synonym: benzoylformic acid,phenylglyoxylic acid,oxophenylacetic acid,benzeneglyoxylic acid,phenylgloxylic acid,2-phenylethanoic acid,oxo phenyl acetic acid,benzoylformate,phenylglyoxalate,phenyloxoacetic acid PubChem CID: 11915 ChEBI: CHEBI:18280 IUPAC Name: 2-oxo-2-phenylacetic acid SMILES: OC(=O)C(=O)C1=CC=CC=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
(S)-2-Methyl-CBS-oxazaborolidine, 1M soln. in toluene
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
3,5-Dibromosalicylic acid, 97%, Thermo Scientific™
CAS: 3147-55-5 Molecular Formula: C7H4Br2O3 Molecular Weight (g/mol): 295.9 InChI Key: BFBZHSOXKROMBG-UHFFFAOYSA-N Synonym: 3,5-dibromosalicylic acid,benzoic acid, 3,5-dibromo-2-hydroxy,2-hydroxy-3,5-dibromobenzoic acid,unii-t5jo5ua21h,salicylic acid, 3,5-dibromo,t5jo5ua21h,rarechem al bo 2002,attercop-chm at113669,labotest-bb lt00455167,labotest-bb lt03333482 PubChem CID: 18464 IUPAC Name: 3,5-dibromo-2-hydroxybenzoic acid SMILES: C1=C(C=C(C(=C1Br)O)C(=O)O)Br
2,3,6-Trifluorobenzaldehyde, 97%, Thermo Scientific™
CAS: 104451-70-9 Molecular Formula: C7H3F3O Molecular Weight (g/mol): 160.10 MDL Number: MFCD00061195 InChI Key: XSBAHBVACIKRTG-UHFFFAOYSA-N Synonym: benzaldehyde, 2,3,6-trifluoro,2,3,6-trifluoro-benzaldehyde,pubchem1467,acmc-1bqm6,2,3,6-trifluorobenzoaldehyde,ksc494g2t,2,3,6-trifluoro benzaldehyde,timtec-bb sbb003970,attercop-chm at111497 PubChem CID: 517845 IUPAC Name: 2,3,6-trifluorobenzaldehyde SMILES: FC1=CC=C(F)C(C=O)=C1F
2-Fluoro-4-(trifluoromethyl)benzaldehyde, 97%
CAS: 89763-93-9 Molecular Formula: C8H4F4O Molecular Weight (g/mol): 192.113 MDL Number: MFCD00061310 InChI Key: KFEHNXLFIGPWNB-UHFFFAOYSA-N Synonym: 2-fluoro-4-trifluoromethyl benzaldehyde,benzaldehyde, 2-fluoro-4-trifluoromethyl,pubchem4235,acmc-209r2s,ksc496e9p,attercop-chm at111109,a,a,a,2-tetrafluoro-p-tolualdehyde,2-fluoro-4-trifluoromethyl benzaldehy,2-fluoro-4-trifluoromethyl-benzaldehyde,2-fluoro4-trifluoromethyl benzaldehyde PubChem CID: 522929 IUPAC Name: 2-fluoro-4-(trifluoromethyl)benzaldehyde SMILES: C1=CC(=C(C=C1C(F)(F)F)F)C=O
2-Amino-6-bromobenzoic acid, 97+%
CAS: 20776-48-1 Molecular Formula: C7H6BrNO2 Molecular Weight (g/mol): 216.03 MDL Number: MFCD03618455 InChI Key: BNQPROAXWQCNKO-UHFFFAOYSA-N Synonym: 6-bromoanthranilic acid,3-bromo-2-carboxyaniline,benzoic acid, 2-amino-6-bromo,buttpark 49\07-50,2-amino-6-bromo-benzoic acid,ksc201s8r PubChem CID: 10560649 IUPAC Name: 2-amino-6-bromobenzoic acid SMILES: NC1=C(C(O)=O)C(Br)=CC=C1
4-Methoxybenzophenone, 97%
CAS: 611-94-9 Molecular Formula: C14H12O2 Molecular Weight (g/mol): 212.25 MDL Number: MFCD00008403 InChI Key: SWFHGTMLYIBPPA-UHFFFAOYSA-N Synonym: 4-methoxybenzophenone,4-methoxyphenyl phenyl methanone,p-methoxybenzophenone,benzophenone, 4-methoxy,methanone, 4-methoxyphenyl phenyl,phenyl p-anisyl ketone,4-benzoylanisole,4-methoxyphenyl phenylmethanone,unii-i4xj07373m,4-methoxyphenyl-phenylmethanone PubChem CID: 69146 IUPAC Name: (4-methoxyphenyl)-phenylmethanone SMILES: COC1=CC=C(C=C1)C(=O)C2=CC=CC=C2
9-Vinylanthracene, 97%
CAS: 2444-68-0 Molecular Formula: C16H12 Molecular Weight (g/mol): 204.272 MDL Number: MFCD00003576 InChI Key: OGOYZCQQQFAGRI-UHFFFAOYSA-N Synonym: 9-vinylanthracene,anthracene, 9-ethenyl,unii-a3692nge8j,9-vinyl-anthracene,9-ethenyl anthracene,9-ethenylanthracen,10-vinylanthracene PubChem CID: 17125 IUPAC Name: 9-ethenylanthracene SMILES: C=CC1=C2C=CC=CC2=CC3=CC=CC=C31
4-Methyl-3-nitrobenzenesulfonyl chloride, 95%, Thermo Scientific Chemicals
CAS: 616-83-1 Molecular Formula: C7H6ClNO4S Molecular Weight (g/mol): 235.638 MDL Number: MFCD00129811 InChI Key: OQFYBGANSUNUAO-UHFFFAOYSA-N Synonym: 4-methyl-3-nitrobenzene-1-sulfonyl chloride,2-nitrotoluene-4-sulfonyl chloride,4-methyl-3-nitro-benzenesulfonyl chloride,4-methyl-3-nitrobenzenesulfonylchloride,chloro 4-methyl-3-nitrophenyl sulfone,4-methyl-3-nitrobenzolsulfonylchlorid,pubchem5674,acmc-1awd3,3-nitro-p-toluenesulfonyl chloride,3-nitro-4-methyl phenylsulfonyl chloride PubChem CID: 560638 IUPAC Name: 4-methyl-3-nitrobenzenesulfonyl chloride SMILES: CC1=C(C=C(C=C1)S(=O)(=O)Cl)[N+](=O)[O-]
3-Fluorophenyl isocyanate, 97+%
CAS: 404-71-7 Molecular Formula: C7H4FNO Molecular Weight (g/mol): 137.11 MDL Number: MFCD00002015 InChI Key: RIKWVZGZRYDACA-UHFFFAOYSA-N Synonym: 3-fluorophenyl isocyanate,m-fluorophenyl isocyanate,3-fluorophenylisocyanate,m-fluorophenylisocyanate,benzene, 1-fluoro-3-isocyanato,3-isocyanatofluorobenzene,isocyanic acid 3-fluorophenyl ester,3-fluorobenzenisocyanate,pubchem4995,acmc-1ajez PubChem CID: 123064 IUPAC Name: 1-fluoro-3-isocyanatobenzene SMILES: FC1=CC=CC(=C1)N=C=O
4-Vinylphenol, min 10% soln. in propylene glycol
CAS: 2628-17-3 Molecular Formula: C8H8O Molecular Weight (g/mol): 120.151 MDL Number: MFCD00017593 InChI Key: FUGYGGDSWSUORM-UHFFFAOYSA-N Synonym: 4-vinylphenol,4-hydroxystyrene,p-vinylphenol,p-hydroxystyrene,phenol, 4-ethenyl,4-vinylphenol, 10 wt.% in propylene glycol,phenol, p-vinyl,unii-oa7v1sm8yl,fema no. 3739,poly 4-hydroxystyrene PubChem CID: 62453 ChEBI: CHEBI:1883 IUPAC Name: 4-ethenylphenol SMILES: C=CC1=CC=C(C=C1)O
3-Methyl-1-phenyl-2-phospholene 1-oxide, 94%
CAS: 707-61-9 Molecular Formula: C11H13OP Molecular Weight (g/mol): 192.198 MDL Number: MFCD00014518 InChI Key: YMKWWHFRGALXLE-UHFFFAOYSA-N Synonym: 3-methyl-1-phenyl-2-phospholene 1-oxide,3-methyl-1-phenyl-2-phospholene-1-oxide,2,3-dihydro-4-methyl-1-phenyl-1h-phosphole 1-oxide,1h-phosphole, 2,3-dihydro-4-methyl-1-phenyl-, 1-oxide,4-methyl-1-phenyl-2,3-dihydro-1h-phosphole 1-oxide,2-phospholene, 3-methyl-1-phenyl-, 1-oxide,2,3-dihydro-4-methyl-1-phenyl-1h-phosphole, 1-oxide,4-methyl-1-phenyl-2,3-dihydro-1$l^ 5-phosphole 1-oxide,3-methyl-1-phenyl-4,5-dihydro-1??-phosphol-1-one,2-phospholene, 1-oxide PubChem CID: 69722 IUPAC Name: 4-methyl-1-phenyl-2,3-dihydro-1$l^{5}-phosphole 1-oxide SMILES: CC1=CP(=O)(CC1)C2=CC=CC=C2