Organooxygen compounds
1,8-Dihydroxyanthraquinone, 95%
CAS: 117-10-2 Molecular Formula: C14H8O4 Molecular Weight (g/mol): 240.21 MDL Number: MFCD00001211 InChI Key: QBPFLULOKWLNNW-UHFFFAOYSA-N Synonym: danthron,1,8-dihydroxyanthraquinone,chrysazin,dantron,antrapurol,laxanthreen,diaquone,istizin,laxanorm,altan PubChem CID: 2950 ChEBI: CHEBI:3682 IUPAC Name: 1,8-dihydroxyanthracene-9,10-dione SMILES: C1=CC2=C(C(=C1)O)C(=O)C3=C(C2=O)C=CC=C3O
2-Methyl-2-propen-1-ol, 98%
CAS: 513-42-8 Molecular Formula: C4H8O Molecular Weight (g/mol): 72.11 MDL Number: MFCD00004737 InChI Key: BYDRTKVGBRTTIT-UHFFFAOYSA-N Synonym: methallyl alcohol,2-methyl-2-propen-1-ol,2-methylallyl alcohol,isopropenyl carbinol,2-propen-1-ol, 2-methyl,beta-methallyl alcohol,methacryl alcohol,3-hydroxy-2-methylpropene,beta-methylallyl alcohol,2-methyl-2-propene-1-ol PubChem CID: 10557 IUPAC Name: 2-methylprop-2-en-1-ol SMILES: CC(=C)CO
Ethyl isobutyrylacetate, 95%
CAS: 7152-15-0 Molecular Formula: C8H14O3 Molecular Weight (g/mol): 158.2 MDL Number: MFCD00009198 InChI Key: XCLDSQRVMMXWMS-UHFFFAOYSA-N Synonym: ethyl isobutyrylacetate,4-methyl-3-oxo-pentanoic acid ethyl ester,pentanoic acid, 4-methyl-3-oxo-, ethyl ester,ethyl isobutyroylacetate,valeric acid, 4-methyl-3-oxo-, ethyl ester,.gamma.,.gamma.-dimethylacetoacetic acid ethyl ester,beta-keto-gamma-methylvaleric acid ethyl ester,ethyl alpha-isobutyroylacetate,ethylisobutyrylacetate,ethyl iso-butyrylacetate PubChem CID: 81583 IUPAC Name: ethyl 4-methyl-3-oxopentanoate SMILES: CCOC(=O)CC(=O)C(C)C
5-Methyl-1-indanone, 97%
CAS: 4593-38-8 Molecular Formula: C10H10O Molecular Weight (g/mol): 146.189 MDL Number: MFCD02179276 InChI Key: KBHCTNGQJOEDDC-UHFFFAOYSA-N Synonym: 5-methyl-1-indanone,5-methyl-2,3-dihydro-1h-inden-1-one,5-methylindan-1-one,5-methyl-indanone,1h-inden-1-one, 2,3-dihydro-5-methyl,5-methy1-2,3-dihydroinden-1-one,5-methylindanone,pubchem8850,1h-inden-1-one,2,3-dihydro-5-methyl PubChem CID: 10130031 IUPAC Name: 5-methyl-2,3-dihydroinden-1-one SMILES: CC1=CC2=C(C=C1)C(=O)CC2
MilliporeSigma™ JC-1, Calbiochem™,
CAS: 47729-63-5 Molecular Formula: C25H27Cl4IN4 Molecular Weight (g/mol): 652.223 InChI Key: FYNNIUVBDKICAX-UHFFFAOYSA-M Synonym: jc-1,jc1 dye,jc-1 jodide,cbic2 3,5,5',6,6'-tetrachloro-1,1',3,3'-tetraethylbenzimidazolocarbocyanine iodide,1,1',3,3'-tetraethyl-5,5',6,6'-tetrachloroimidacarbocyanine iodide,bis 5,6-dichloro-1,3-diethyl-2-benzimidazole trimethinecyanine iodide,1,1',3,3'-tetraethyl-5,5',6,6'-tetrachlorobenzimidazolocarbocyanine iodide,5,6-dichloro-2-3-5,6-dichloro-1,3-diethyl-2-benzimidazolinylidene propenyl-1,3-diethylbenzimidazolium iodide,cbic2 PubChem CID: 5492929 ChEBI: CHEBI:52097 IUPAC Name: 5,6-dichloro-2-[(E)-3-(5,6-dichloro-1,3-diethylbenzimidazol-3-ium-2-yl)prop-2-enylidene]-1,3-diethylbenzimidazole;iodide SMILES: CCN1C2=CC(=C(C=C2[N+](=C1C=CC=C3N(C4=CC(=C(C=C4N3CC)Cl)Cl)CC)CC)Cl)Cl.[I-]
4'-Acetoxyacetophenone, 99%
CAS: 13031-43-1 Molecular Formula: C10H10O3 Molecular Weight (g/mol): 178.19 MDL Number: MFCD00017229 InChI Key: SMIOEQSLJNNKQF-UHFFFAOYSA-N Synonym: 4'-acetoxyacetophenone,p-acetoxyacetophenone,4-acetoxyacetophenone,p-acetylphenyl acetate,4-acetylphenyl acetate,unii-eo1xk390jf,ethanone, 1-4-acetyloxy phenyl,4-acetoxy acetophenone,4-acetoxy-acetophenone,eo1xk390jf PubChem CID: 83063 ChEBI: CHEBI:86558 IUPAC Name: (4-acetylphenyl) acetate SMILES: CC(=O)OC1=CC=C(C=C1)C(C)=O
2-(4-Aminophenyl)ethanol, 97%
CAS: 104-10-9 Molecular Formula: C8H11NO Molecular Weight (g/mol): 137.182 MDL Number: MFCD00007922 InChI Key: QXHDYMUPPXAMPQ-UHFFFAOYSA-N Synonym: 2-4-aminophenyl ethanol,4-aminophenethyl alcohol,p-aminophenethyl alcohol,p-aminophenylethanol,benzeneethanol, 4-amino,2-p-aminophenyl ethanol,2-4-aminophenyl ethan-1-ol,4-2-hydroxyethyl aniline,benzeneethanol, ar-amino,p-2-hydroxyethyl aniline PubChem CID: 66904 IUPAC Name: 2-(4-aminophenyl)ethanol SMILES: C1=CC(=CC=C1CCO)N
3-Ethyl-1-pentyn-3-ol, 98%
CAS: 6285-06-9 MDL Number: MFCD00014392
2-Ethoxypyridine-5-boronic acid pinacol ester, 99%, Thermo Scientific Chemicals
CAS: 1072945-01-7 Molecular Formula: C13H20BNO3 Molecular Weight (g/mol): 249.117 MDL Number: MFCD07781182 InChI Key: GXUHWEZZHFBDFA-UHFFFAOYSA-N Synonym: 2-ethoxy-5-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl pyridine,6-ethoxypyridine-3-boronic acid pinacol ester,2-ethoxy-5-4,4,5,5-tetramethyl-1,3,2 dioxaborolan-2-yl-pyridine,2-ethoxypyridine-5-boronic acid pinacol ester,2-ethoxypyridine-5-boronic acid, pinacol ester,pubchem20146,6-ethoxypyridine-3-boronicacidpinacolester,6-ethoxypyridin-3-ylboronic acid pinacol ester,2-ethoxy-5-tetramethyl-1,3,2-dioxaborolan-2-yl pyridine,2-ethoxy-5-4,4,5,5-tetramethyl-1,3,2 dioxaborolan-2-yl pyridine PubChem CID: 24208796 IUPAC Name: 2-ethoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine SMILES: B1(OC(C(O1)(C)C)(C)C)C2=CN=C(C=C2)OCC
1-Benzothiophene-5-carbaldehyde, 97%, Thermo Scientific™
CAS: 10133-30-9 Molecular Formula: C9H6OS Molecular Weight (g/mol): 162.21 MDL Number: MFCD05663673 InChI Key: QHHRWAPVYHRAJA-UHFFFAOYSA-N Synonym: benzo b thiophene-5-carbaldehyde,benzo b thiophene-5-carboxaldehyde,5-formylbenzo b thiophene,1-benzothiophene-5-carboxaldehyde,benzothiophene-5-carbaldehyde,5-thionaphthenecarbaldehyde PubChem CID: 139097 IUPAC Name: 1-benzothiophene-5-carbaldehyde SMILES: O=CC1=CC=C2SC=CC2=C1
3'-Bromo-4'-fluoroacetophenone, 98+%
CAS: 1007-15-4 Molecular Formula: C8H6BrFO Molecular Weight (g/mol): 217.04 MDL Number: MFCD00042466 InChI Key: SZDWTGAORQQQGY-UHFFFAOYSA-N Synonym: 3'-bromo-4'-fluoroacetophenone,3-bromo-4-fluoroacetophenone,1-3-bromo-4-fluorophenyl ethanone,1-3-bromo-4-fluorophenyl ethan-1-one,ethanone, 1-3-bromo-4-fluorophenyl,1-3-bromo-4-fluoro-phenyl-ethanone,1-acetyl-3-bromo-4-fluorobenzene,pubchem4100,acmc-1bol8,ksc499c8t PubChem CID: 70508 IUPAC Name: 1-(3-bromo-4-fluorophenyl)ethanone SMILES: CC(=O)C1=CC=C(F)C(Br)=C1
2-Bromo-4'-nitroacetophenone, 95%
CAS: 99-81-0 Molecular Formula: C8H6BrNO3 Molecular Weight (g/mol): 244.044 MDL Number: MFCD00007356 InChI Key: MBUPVGIGAMCMBT-UHFFFAOYSA-N Synonym: 2-bromo-4'-nitroacetophenone,2-bromo-1-4-nitrophenyl ethanone,4-nitrophenacyl bromide,p-nitrophenacyl bromide,2-bromo-1-4-nitrophenyl ethan-1-one,alpha-bromo-p-nitroacetophenone,ethanone, 2-bromo-1-4-nitrophenyl,4'-nitrophenacyl bromide,alpha-bromo-4-nitroacetophenone,2-bromo-4-nitroacetophenone PubChem CID: 66840 IUPAC Name: 2-bromo-1-(4-nitrophenyl)ethanone SMILES: C1=CC(=CC=C1C(=O)CBr)[N+](=O)[O-]
2-n-Propyl-1-pentanol, 97%
CAS: 58175-57-8 Molecular Formula: C8H18O Molecular Weight (g/mol): 130.231 MDL Number: MFCD00010260 InChI Key: LASHFHLFDRTERB-UHFFFAOYSA-N Synonym: 2-propyl-1-pentanol,1-pentanol, 2-propyl,2-propylpentanol,2-n-propyl-1-pentanol,acmc-1azt3,2-propyl-1-hydroxypentane PubChem CID: 123543 IUPAC Name: 2-propylpentan-1-ol SMILES: CCCC(CCC)CO
6-Fluoroindole-3-carboxaldehyde, 98%
CAS: 2795-41-7 Molecular Formula: C9H6FNO Molecular Weight (g/mol): 163.15 MDL Number: MFCD00069703 InChI Key: CWCYUOSLRVAKQZ-UHFFFAOYSA-N Synonym: 6-fluoroindole-3-carboxaldehyde,6-fluoroindole-3-carbaldehyde,6-fluoroindole-3-aldehyde,6-fluoro-1h-indole-3-carboxaldehyde,1h-indole-3-carboxaldehyde, 6-fluoro,1h-6-fluoroindole-3-carboxaldehyde,pubchem7269,ksc495g4p,6-fluoro-3-formyl-1h-indole,6-fluorooindole-3-carboxaldehyde PubChem CID: 262903 IUPAC Name: 6-fluoro-1H-indole-3-carbaldehyde SMILES: FC1=CC=C2C(NC=C2C=O)=C1
Shikimic Acid, ≥98%, MP Biomedicals™
CAS: 138-59-0 Molecular Formula: C7H9O5- Molecular Weight (g/mol): 173.144 MDL Number: MFCD00066278 InChI Key: JXOHGGNKMLTUBP-HSUXUTPPSA-M Synonym: shikimic acid,shikimate,--shikimic acid,l-shikimic acid,3r,4s,5r-3,4,5-trihydroxycyclohex-1-enecarboxylic acid,3r,4s,5r-3,4,5-trihydroxycyclohex-1-ene-1-carboxylic acid,--shikimate,ccris 7681,unii-29ms2wi2nu,3alpha,4alpha,5beta-trihydroxy-1-cyclohexene-1-carboxylic acid PubChem CID: 7057976 ChEBI: CHEBI:36208 IUPAC Name: (3R,4S,5R)-3,4,5-trihydroxycyclohexene-1-carboxylate SMILES: C1C(C(C(C=C1C(=O)[O-])O)O)O