Organooxygen compounds
N1-(4-acetyl-3-hydroxyphenyl)acetamide, Thermo Scientific™
CAS: 40547-58-8 Molecular Formula: C10H11NO3 Molecular Weight (g/mol): 193.202 InChI Key: ZSSHNMZQDWSUJJ-UHFFFAOYSA-N Synonym: n-4-acetyl-3-hydroxyphenyl acetamide,n1-4-acetyl-3-hydroxyphenyl acetamide,4'-acetamido-2'-hydroxyacetophenone,acetamide, n-4-acetyl-3-hydroxyphenyl,4-acetamido-2-hydroxyacetophenone,n-4-acetyl-3-hydroxy-phenyl acetamide,n-4-acetyl-3-hydroxy-phenyl-acetamide PubChem CID: 2775185 IUPAC Name: N-(4-acetyl-3-hydroxyphenyl)acetamide SMILES: CC(=O)C1=C(C=C(C=C1)NC(=O)C)O
2-Quinolinecarbaldehyde, ≥97%, Thermo Scientific™
CAS: 5470-96-2 Molecular Formula: C10H7NO Molecular Weight (g/mol): 157.17 MDL Number: MFCD00075032 InChI Key: WPYJKGWLDJECQD-UHFFFAOYSA-N Synonym: 2-quinolinecarboxaldehyde,quinoline-2-carboxaldehyde,2-quinolinecarbaldehyde,2-formylquinoline,quinaldaldehyde,quinolinecarboxaldehyde,quinoline aldehyde,quinoline-2-aldehyde,zlchem 599,pubchem2277 PubChem CID: 79619 IUPAC Name: quinoline-2-carbaldehyde SMILES: O=CC1=CC=C2C=CC=CC2=N1
2'-Fluoro-4'-methoxyacetophenone, 99%
CAS: 74457-86-6 Molecular Formula: C9H9FO2 Molecular Weight (g/mol): 168.17 MDL Number: MFCD00042290 InChI Key: PIRRWUMTIBFCCW-UHFFFAOYSA-N Synonym: 2'-fluoro-4'-methoxyacetophenone,2-fluoro-4-methoxyacetophenone,1-2-fluoro-4-methoxyphenyl ethanone,1-2-fluoro-4-methoxyphenyl ethan-1-one,4-acetyl-3-fluoroanisole,1-acetyl-2-fluoro-4-methoxybenzene,2'-fluor-4'-methoxyacetophenone,2-fluoro-4-methoxy-acetophenone,ethanone, 1-2-fluoro-4-methoxyphenyl,zlchem 344 PubChem CID: 592821 IUPAC Name: 1-(2-fluoro-4-methoxyphenyl)ethanone SMILES: COC1=CC=C(C(C)=O)C(F)=C1
(1-methyl-5-phenyl-1H-pyrazol-4-yl)methanol, Thermo Scientific™
CAS: 499785-47-6 Molecular Formula: C11H12N2O Molecular Weight (g/mol): 188.23 MDL Number: MFCD04115390 InChI Key: ZVGZXURABHDVPS-UHFFFAOYSA-N Synonym: 1-methyl-5-phenyl-1h-pyrazol-4-yl methanol,1-methyl-5-phenylpyrazol-4-yl methanol,1-methyl-5-phenylpyrazol-4-yl methan-1-ol,bck PubChem CID: 2795476 SMILES: CN1N=CC(CO)=C1C1=CC=CC=C1
4'-Cyclohexylacetophenone, 99%
CAS: 18594-05-3 Molecular Formula: C14H18O Molecular Weight (g/mol): 202.30 MDL Number: MFCD00001453 InChI Key: MSDQNIRGPBARGC-UHFFFAOYSA-N Synonym: 4'-cyclohexylacetophenone,1-4-cyclohexylphenyl ethanone,1-4-cyclohexylphenyl ethan-1-one,4-cyclohexylacetophenone,ethanone, 1-4-cyclohexylphenyl,1-acetyl-4-cyclohexylbenzene,p-cyclohexylacetophenone,acmc-209ena,4-cyclohexylace-tophenone,4'-cyclohexyl actephenone PubChem CID: 87715 SMILES: CC(=O)C1=CC=C(C=C1)C1CCCCC1
1-(3-Aminophenyl)ethanol, 98%
CAS: 2454-37-7 Molecular Formula: C8H11NO Molecular Weight (g/mol): 137.182 MDL Number: MFCD00007798 InChI Key: QPKNDHZQPGMLCJ-UHFFFAOYSA-N Synonym: 1-3-aminophenyl ethanol,3-1-hydroxyethyl aniline,m-1-hydroxyethyl aniline,m-amino-alpha-methylbenzyl alcohol,m-aminophenyl methyl carbinol,1-3-aminophenyl ethan-1-ol,3-amino-alpha-methylbenzyl alcohol,benzyl alcohol, m-amino-alpha-methyl,3-aminophenyl-1-ethanol,benzyl alcohol, m-amino-.alpha.-methyl PubChem CID: 222461 IUPAC Name: 1-(3-aminophenyl)ethanol SMILES: CC(C1=CC(=CC=C1)N)O
6-Methoxy-2-naphthylglyoxal hydrate, 98%, dry wt. basis
CAS: 745783-88-4 Molecular Formula: C13H12O4 Molecular Weight (g/mol): 232.235 MDL Number: MFCD05664091 InChI Key: CBFAHRRUWMTAQH-UHFFFAOYSA-N Synonym: 6-methoxynaphthylglyoxal hydrate,2-6-methoxynaphthalen-1-yl-2-oxoacetaldehyde hydrate,2-6-methoxy-1-naphthyl-2-oxo-acetaldehyde,pubchem12296,2-6-methoxynaphthyl-2-oxoethanal, hydrate,2-6-methoxy-1-naphthalenyl-2-oxoacetaldehyde hydrate,6-methoxynaphthalen-1-yl oxo acetaldehyde-water 1/1,2-6-methoxynaphthalen-1-yl-2-oxidanylidene-ethanal hydrate PubChem CID: 44118759 IUPAC Name: 2-(6-methoxynaphthalen-1-yl)-2-oxoacetaldehyde;hydrate SMILES: COC1=CC2=C(C=C1)C(=CC=C2)C(=O)C=O.O
1-(4-Amino-2-hydroxyphenyl)ethan-1-one, Tech., Thermo Scientific™
CAS: 2476-29-1 Molecular Formula: C8H9NO2 Molecular Weight (g/mol): 151.17 MDL Number: MFCD00100636 InChI Key: QQZFVONVJPXCSQ-UHFFFAOYSA-N Synonym: 1-4-amino-2-hydroxyphenyl ethanone,1-4-amino-2-hydroxyphenyl ethan-1-one,4'-amino-2'-hydroxyacetophenone,1-4-amino-2-hydroxyphenyl ethane-1-one,ethanone, 1-4-amino-2-hydroxyphenyl,1-4-amino-2-hydroxy-phenyl ethanone,2-acetyl-5-aminophenol,intermediates-zcf02667,amino-2-hydroxyphenyl ethanone,4-acetyl-3-hydroxyaniline PubChem CID: 459296 IUPAC Name: 1-(4-amino-2-hydroxyphenyl)ethanone SMILES: CC(=O)C1=C(O)C=C(N)C=C1
2-Acetyl-5-bromothiophene, 99%
CAS: 5370-25-2 Molecular Formula: C6H5BrOS Molecular Weight (g/mol): 205.069 MDL Number: MFCD00014528 InChI Key: IGBZCOWXSCWSHO-UHFFFAOYSA-N Synonym: 2-acetyl-5-bromothiophene,1-5-bromothiophen-2-yl ethanone,ethanone, 1-5-bromo-2-thienyl,1-5-bromo-2-thienyl ethan-1-one,1-5-bromothiophen-2-yl ethan-1-one,5-bromo-2-thienyl methyl ketone,2-acetyl-5-bromo thiophene,ketone, 5-bromo-2-thienyl methyl,2-acetyl-5-bromo-thiophene,1-5-bromo-2-thienyl ethanone PubChem CID: 79335 IUPAC Name: 1-(5-bromothiophen-2-yl)ethanone SMILES: CC(=O)C1=CC=C(S1)Br
Ethyl 3-(4-methoxybenzoyl)propionate, 98%
CAS: 15118-67-9 Molecular Formula: C13H16O4 Molecular Weight (g/mol): 236.267 MDL Number: MFCD00051784 InChI Key: FYUAOZFEVHSJTO-UHFFFAOYSA-N Synonym: ethyl 3-4-methoxybenzoyl propionate,ethyl 4-4-methoxyphenyl-4-oxobutanoate,ethyl 4-4-methoxyphenyl-4-oxobutyrate,acmc-1ciqg,ethyl 3-4-methoxybenzoylpropionate,ethyl 3-4-methoxybenzoyl propanoate,ethyl 3-4-methoxybenzoyl-propionate,ethyl 4-4-methoxyphenyl-4-oxobutanoate #,gamma-oxo-4-methoxybenzenebutyric acid ethyl ester,4-4-methoxyphenyl-4-oxobutyric acid, ethyl ester PubChem CID: 585132 IUPAC Name: ethyl 4-(4-methoxyphenyl)-4-oxobutanoate SMILES: CCOC(=O)CCC(=O)C1=CC=C(C=C1)OC
2-Butynal diethyl acetal, 98%
CAS: 2806-97-5 Molecular Formula: C8H14O2 Molecular Weight (g/mol): 142.20 MDL Number: MFCD00009274 InChI Key: FKKVKKSEVMQYER-UHFFFAOYSA-N Synonym: 2-butynal diethyl acetal,2-butyn-1-al diethyl acetal,2-butynyl aldehyde diethyl acetal,2-butyne, 1,1-diethoxy,1,1-diethoxy-but-2-yne,1-diethoxybut-2-yne,acmc-20ao12,tetrolaldehyde diethyl acetal,1,1-diethoxy-2-butyne # PubChem CID: 137721 IUPAC Name: 1,1-diethoxybut-2-yne SMILES: CCOC(OCC)C#CC
3,5-Dihydroxybenzaldehyde, 98%
CAS: 26153-38-8 Molecular Formula: C7H6O3 Molecular Weight (g/mol): 138.12 MDL Number: MFCD00016611 InChI Key: HAQLHRYUDBKTJG-UHFFFAOYSA-N Synonym: benzaldehyde, 3,5-dihydroxy,3,5-dihydroxy benzaldehyde,5-formylresorcinol,5-formylbenzene-1,3-diol,pubchem8249,alpha-resorcylic aldehyde,acmc-1cg7h,3,5-dihydoxybenzal dehyde,3,5-dihydroxy-benzaldehyde,.alpha.-resorcylic aldehyde PubChem CID: 94365 ChEBI: CHEBI:50204 IUPAC Name: 3,5-dihydroxybenzaldehyde SMILES: OC1=CC(C=O)=CC(O)=C1
3,5-Dimethyl-1H-pyrrole-2-carbaldehyde, ≥95%, Thermo Scientific™
CAS: 2199-58-8 Molecular Formula: C7H9NO Molecular Weight (g/mol): 123.155 MDL Number: MFCD00111522 InChI Key: RDFZYUOHJBXMJA-UHFFFAOYSA-N Synonym: 3,5-dimethylpyrrole-2-carboxaldehyde,3,5-dimethyl-1h-pyrrole-2-carboxaldehyde,1h-pyrrole-2-carboxaldehyde, 3,5-dimethyl,3,5-dimethyl-2-pyrrolecarboxaldehyde,pubchem2127,acmc-209fqe,ksc202o9r,3,5-dimethyl-2-formylpyrrol,2,4-dimethyl-5-formylpyrrole,2-formyl-3,5-dimethylpyrrole PubChem CID: 270465 IUPAC Name: 3,5-dimethyl-1H-pyrrole-2-carbaldehyde SMILES: CC1=CC(=C(N1)C=O)C
2-(4-Methylphenyl)ethanol, 99%
CAS: 699-02-5 Molecular Formula: C9H12O Molecular Weight (g/mol): 136.194 MDL Number: MFCD00002904 InChI Key: DAVFJRVIVZOKKS-UHFFFAOYSA-N Synonym: 2-4-methylphenyl ethanol,2-p-tolyl ethanol,4-methylphenethyl alcohol,benzeneethanol, 4-methyl,2-p-tolylethanol,p-methylphenethyl alcohol,4-methylbenzeneethanol,2-4-methylphenyl ethan-1-ol,p-methylphenylethyl alcohol,2-p-methylphenyl ethanol PubChem CID: 95294 IUPAC Name: 2-(4-methylphenyl)ethanol SMILES: CC1=CC=C(C=C1)CCO