Organooxygen compounds
2-Bromo-2'-(trifluoromethyl)acetophenone, 97%
CAS: 54109-16-9 Molecular Formula: C9H6BrF3O Molecular Weight (g/mol): 267.045 MDL Number: MFCD03094304 InChI Key: KWZCBMKXNYOQAK-UHFFFAOYSA-N Synonym: 2-trifluoromethyl phenacyl bromide,2-bromo-1-2-trifluoromethyl phenyl-1-ethanone,2-bromo-2'-trifluoromethyl acetophenone,2-bromo-1-2-trifluoromethyl-phenyl-ethanone,2-bromo-1-2-trifluoromethyl phenyl ethan-1-one,2-bromo-1-2-trifluoromethyl phenyl ethanone,ethanone, 2-bromo-1-2-trifluoromethyl phenyl,2-trifluoromethyphenacyl bromide,2-trifluoromethyl phenacylbromide PubChem CID: 2778430 IUPAC Name: 2-bromo-1-[2-(trifluoromethyl)phenyl]ethanone SMILES: C1=CC=C(C(=C1)C(=O)CBr)C(F)(F)F
2-Aminoacetophenone hydrochloride, 96%
CAS: 5468-37-1 Molecular Formula: C8H10ClNO Molecular Weight (g/mol): 171.62 MDL Number: MFCD00012873 InChI Key: CVXGFPPAIUELDV-UHFFFAOYSA-N Synonym: 2-aminoacetophenone hydrochloride,2-amino-1-phenylethanone hydrochloride,phenacylamine hydrochloride,2-aminoacetophenone hcl,2-aminoacetophenonehydrochloride,2-amino-1-phenylethan-1-one hydrochloride,alpha-aminoacetophenone hydrochloride,2-aminoacetophenonehcl,ethanone, 2-amino-1-phenyl-, hydrochloride,omega-aminoacetophenone hydrochloride PubChem CID: 2723597 IUPAC Name: 2-amino-1-phenylethanone;hydrochloride SMILES: Cl.NCC(=O)C1=CC=CC=C1
N-Phenacylpyridinium bromide, 97%, Thermo Scientific™
CAS: 16883-69-5 Molecular Formula: C13H12BrNO Molecular Weight (g/mol): 278.15 InChI Key: PXSUMUYPXZEXDT-UHFFFAOYSA-M Synonym: 1-phenacylpyridinium bromide,1-2-oxo-2-phenylethyl pyridin-1-ium bromide,n-phenacylpyridinium bromide,1-phenacylpyridiniumbromide,1-acetophenonepyridinium bromide,1-2-oxo-2-phenylethyl pyridinium bromide,1-2-oxo-2-phenyl-ethyl-pyridinium, bromide,phenacylpyridinium bromide,acmc-1c6a6,1-phenacyl-pyridinium bromide PubChem CID: 2798954 IUPAC Name: 1-phenyl-2-pyridin-1-ium-1-ylethanone;bromide SMILES: C1=CC=C(C=C1)C(=O)C[N+]2=CC=CC=C2.[Br-]
3-Acetylbenzonitrile, 97+%
CAS: 6136-68-1 Molecular Formula: C9H7NO Molecular Weight (g/mol): 145.16 MDL Number: MFCD00001806 InChI Key: SBCFGFDAZCTSRH-UHFFFAOYSA-N Synonym: m-cyanoacetophenone,3'-cyanoacetophenone,benzonitrile, 3-acetyl,3-cyanoacetophenone,3-acetyl-benzonitrile,unii-tsj72034p9,3-acetylbenzenecarbonitrile,m-acetylbenzonitrile,3-acetyl benzonitrile,pubchem12649 PubChem CID: 80222 IUPAC Name: 3-acetylbenzonitrile SMILES: CC(=O)C1=CC=CC(=C1)C#N
1-Methylisatin, 98%
CAS: 2058-74-4 Molecular Formula: C9H7NO2 Molecular Weight (g/mol): 161.16 MDL Number: MFCD00005812 InChI Key: VCYBVWFTGAZHGH-UHFFFAOYSA-N Synonym: n-methylisatin,1-methylisatin,1-methyl-1h-indole-2,3-dione,1-methylindoline-2,3-dione,1h-indole-2,3-dione, 1-methyl,1-methyl-indole-2,3-dione,1 methylisatine,n-methylindol-2,3-dione,1-methyl-2,3-dihydro-1h-indole-2,3-dione,1-methyl-2,3-indolinedione PubChem CID: 16358 IUPAC Name: 1-methylindole-2,3-dione SMILES: CN1C(=O)C(=O)C2=CC=CC=C12
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
4-Hydroxy-2-butanone, 95%
CAS: 590-90-9 Molecular Formula: C4H8O2 Molecular Weight (g/mol): 88.106 MDL Number: MFCD00059005 InChI Key: LVSQXDHWDCMMRJ-UHFFFAOYSA-N Synonym: 4-hydroxy-2-butanone,2-butanone, 4-hydroxy,methylolacetone,3-oxo-1-butanol,3-oxobutanol,3-ketobutan-1-ol,monomethylolacetone,4-butanol-2-one,unii-tcm0bj44mf,2-hydroxyethyl methyl ketone PubChem CID: 111509 ChEBI: CHEBI:41268 IUPAC Name: 4-hydroxybutan-2-one SMILES: CC(=O)CCO
4,4,4-Trifluoro-1-(2-furyl)-1,3-butanedione, 98%
CAS: 326-90-9 Molecular Formula: C8H5F3O3 Molecular Weight (g/mol): 206.12 MDL Number: MFCD00020935 InChI Key: OWLPCALGCHDBCN-UHFFFAOYSA-N Synonym: 4,4,4-trifluoro-1-furan-2-yl butane-1,3-dione,2-furoyltrifluoroacetone,furoyltrifluoroacetone,4,4,4-trifluoro-1-2-furyl-1,3-butanedione,perfluoroacetyl 2-furoyl methane,furonyltrifluoroacetone,1,3-butanedione, 4,4,4-trifluoro-1-2-furanyl,4,4,4-trifluoro-1-2-furyl butane-1,3-dione,2-furoyl trifluoro acetone,4,4,4-trifluoro-1-2-furanyl-1,3-butanedione PubChem CID: 67594 IUPAC Name: 4,4,4-trifluoro-1-(furan-2-yl)butane-1,3-dione SMILES: FC(F)(F)C(=O)CC(=O)C1=CC=CO1
2',5'-Dichloroacetophenone, 98%
CAS: 2476-37-1 Molecular Formula: C8H6Cl2O Molecular Weight (g/mol): 189.035 MDL Number: MFCD00000607 InChI Key: CYNFEPKQDJHIMV-UHFFFAOYSA-N Synonym: 2',5'-dichloroacetophenone,1-2,5-dichlorophenyl ethanone,2,5-dichloroacetophenone,ethanone, 1-2,5-dichlorophenyl,acetophenone, 2',5'-dichloro,1-2,5-dichlorophenyl ethan-1-one,1-acetyl-2,5-dichlorobenzene,2,5-dichloracetophenon,pubchem10586,acmc-1cmfm PubChem CID: 75587 IUPAC Name: 1-(2,5-dichlorophenyl)ethanone SMILES: CC(=O)C1=C(C=CC(=C1)Cl)Cl
4-Acetylbenzeneboronic acid, 98%
CAS: 149104-90-5 Molecular Formula: C8H9BO3 Molecular Weight (g/mol): 163.97 MDL Number: MFCD01074667 InChI Key: OBQRODBYVNIZJU-UHFFFAOYSA-N Synonym: 4-acetylphenyl boronic acid,p-acetylphenylboronic acid,4-acetylbenzeneboronic acid,1-4-dihydroxyboranyl phenyl ethan-1-one,boronic acid, 4-acetylphenyl,4acetylphenylboronic acid,4-actylphenylboronic acid,4acetylbenzeneboronic acid,p-acetylbenzeneboronic acid PubChem CID: 3702122 IUPAC Name: (4-acetylphenyl)boronic acid SMILES: CC(=O)C1=CC=C(C=C1)B(O)O
1-(3-Chloro-2-hydroxyphenyl)ethan-1-one, 97%, Thermo Scientific™
CAS: 3226-34-4 Molecular Formula: C8H7ClO2 Molecular Weight (g/mol): 170.59 MDL Number: MFCD00100492 InChI Key: GBWVDQBTXFIIJF-UHFFFAOYSA-N Synonym: 1-3-chloro-2-hydroxyphenyl ethanone,1-3-chloro-2-hydroxyphenyl ethan-1-one,3'-chloro-2'-hydroxyacetophenone,ethanone,1-3-chloro-2-hydroxyphenyl,2'-hydroxy-3'-chloroacetophenone,2'-hydroxy-3'-chloro acetophenone,1-3-chloro-2-hydroxyphenyl-ethanone,1-3-chloro-2-hydroxy-phenyl-ethanone,1-3-chloro-2-hydroxyphenyl ethanone #,2 inverted exclamation mark-hydroxy-3-chloroacetophenone PubChem CID: 593414 IUPAC Name: 1-(3-chloro-2-hydroxyphenyl)ethanone SMILES: CC(=O)C1=C(O)C(Cl)=CC=C1
2'-Chloro-5'-(trifluoromethyl)acetophenone, 96%
CAS: 71648-45-8 Molecular Formula: C9H6ClF3O Molecular Weight (g/mol): 222.591 MDL Number: MFCD00045092 InChI Key: YRGBMTWHOFQSDJ-UHFFFAOYSA-N Synonym: 2'-chloro-5'-trifluoromethyl acetophenone,1-2-chloro-5-trifluoromethyl phenyl ethanone,1-2-chloro-5-trifluoromethyl phenyl ethan-1-one,2-chloro-5-trifluoromethyl acetophenone,acetophenone, 2-chloro-5-trifluoromethyl,3-acetyl-4-chlorobenzotrifluoride,ethanone, 1-2-chloro-5-trifluoromethyl phenyl,1-acetyl-2-chloro-5-trifluoromethyl benzene,pubchem4210 PubChem CID: 144502 IUPAC Name: 1-[2-chloro-5-(trifluoromethyl)phenyl]ethanone SMILES: CC(=O)C1=C(C=CC(=C1)C(F)(F)F)Cl
4-Hydroxy-4-methyl-2-pentanone, 98+%
CAS: 123-42-2 Molecular Formula: C6H12O2 Molecular Weight (g/mol): 116.16 MDL Number: MFCD00004471 InChI Key: SWXVUIWOUIDPGS-UHFFFAOYSA-N Synonym: diacetone alcohol,4-hydroxy-4-methyl-2-pentanone,diacetonalkohol,diketone alcohol,diacetonalcohol,tyranton,acetonyldimethylcarbinol,diacetone-alcool,pyranton a,2-methyl-2-pentanol-4-one PubChem CID: 31256 ChEBI: CHEBI:55381 IUPAC Name: 4-hydroxy-4-methylpentan-2-one SMILES: CC(=O)CC(C)(C)O
2,4-Dibromo-3-pentanone, mixture of stereoisomers, 97%
CAS: 815-60-1 Molecular Formula: C5H8Br2O Molecular Weight (g/mol): 243.926 MDL Number: MFCD00015719 InChI Key: UOPIOAUZQKSZRO-UHFFFAOYSA-N Synonym: 2,4-dibromo-3-pentanone,2,4-dibromo-pentan-3-one,3-pentanone,2,4-dibromo,2,4-bis bromanyl pentan-3-one,2,4-dibromo-3-pentanone, mixture of stereoisomers PubChem CID: 11791395 IUPAC Name: 2,4-dibromopentan-3-one SMILES: CC(C(=O)C(C)Br)Br
Ethyl 2-nitrobenzoylacetate, 97%
CAS: 52119-39-8 Molecular Formula: C11H11NO5 Molecular Weight (g/mol): 237.21 MDL Number: MFCD03424821 InChI Key: OWZNCVIBJQPNEF-UHFFFAOYSA-N Synonym: ethyl 3-2-nitrophenyl-3-oxopropanoate,ethyl 2-nitrobenzoylacetate,acmc-1awhb,ethyl 3-2-nitrophenyl-3-oxo-propanoate,ethyl o-nitrobenzoylacetate,ethyl 2-o-nitrobenzoyl acetate,ethyl 2-2-nitrobenzoyl acetate,ethyl 2-o-nitrobenzoyl-acetate,ethyl 2-nitrobenzoyl acetate PubChem CID: 10561837 IUPAC Name: ethyl 3-(2-nitrophenyl)-3-oxopropanoate SMILES: CCOC(=O)CC(=O)C1=CC=CC=C1[N+](=O)[O-]