Organooxygen compounds
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2-Bromo-4'-chloroacetophenone, 98%
CAS: 536-38-9 Molecular Formula: C8H6BrClO Molecular Weight (g/mol): 233.489 MDL Number: MFCD00000625 InChI Key: FLAYZKKEOIAALB-UHFFFAOYSA-N Synonym: 2-bromo-4'-chloroacetophenone,2-bromo-1-4-chlorophenyl ethanone,4-chlorophenacyl bromide,p-chlorophenacyl bromide,2-bromo-1-4-chlorophenyl ethan-1-one,ethanone, 2-bromo-1-4-chlorophenyl,4'-chlorophenacyl bromide,2-bromo-p-chloroacetophenone,p-bromoacetyl chlorobenzene,4'-chloro-2-bromoacetophenone PubChem CID: 68303 IUPAC Name: 2-bromo-1-(4-chlorophenyl)ethanone SMILES: C1=CC(=CC=C1C(=O)CBr)Cl
| PubChem CID | 68303 |
|---|---|
| CAS | 536-38-9 |
| Molecular Weight (g/mol) | 233.489 |
| MDL Number | MFCD00000625 |
| SMILES | C1=CC(=CC=C1C(=O)CBr)Cl |
| Synonym | 2-bromo-4'-chloroacetophenone,2-bromo-1-4-chlorophenyl ethanone,4-chlorophenacyl bromide,p-chlorophenacyl bromide,2-bromo-1-4-chlorophenyl ethan-1-one,ethanone, 2-bromo-1-4-chlorophenyl,4'-chlorophenacyl bromide,2-bromo-p-chloroacetophenone,p-bromoacetyl chlorobenzene,4'-chloro-2-bromoacetophenone |
| IUPAC Name | 2-bromo-1-(4-chlorophenyl)ethanone |
| InChI Key | FLAYZKKEOIAALB-UHFFFAOYSA-N |
| Molecular Formula | C8H6BrClO |
1-(2-Thenoyl)-3,3,3-trifluoroacetone, 99% (dry wt.) may cont. up to ca 2% water
CAS: 326-91-0 Molecular Formula: C8H5F3O2S Molecular Weight (g/mol): 222.18 MDL Number: MFCD00005445 InChI Key: TXBBUSUXYMIVOS-UHFFFAOYSA-N Synonym: 2-thenoyltrifluoroacetone,thenoyltrifluoroacetone,1,3-butanedione, 4,4,4-trifluoro-1-2-thienyl,4,4,4-trifluoro-1-thiophen-2-yl butane-1,3-dione,4,4,4-trifluoro-1-2-thienyl-1,3-butanedione,4,4,4-trifluoro-1-2-thienyl butane-1,3-dione,perfluoroacetyl 2-thenoyl methane,alpha-thenoyltrifluoroacetone,1-thenoyl-3,3,3-trifluoroacetone,.alpha.-thenoyltrifluoroacetone PubChem CID: 5601 IUPAC Name: 4,4,4-trifluoro-1-thiophen-2-ylbutane-1,3-dione SMILES: FC(F)(F)C(=O)CC(=O)C1=CC=CS1
| PubChem CID | 5601 |
|---|---|
| CAS | 326-91-0 |
| Molecular Weight (g/mol) | 222.18 |
| MDL Number | MFCD00005445 |
| SMILES | FC(F)(F)C(=O)CC(=O)C1=CC=CS1 |
| Synonym | 2-thenoyltrifluoroacetone,thenoyltrifluoroacetone,1,3-butanedione, 4,4,4-trifluoro-1-2-thienyl,4,4,4-trifluoro-1-thiophen-2-yl butane-1,3-dione,4,4,4-trifluoro-1-2-thienyl-1,3-butanedione,4,4,4-trifluoro-1-2-thienyl butane-1,3-dione,perfluoroacetyl 2-thenoyl methane,alpha-thenoyltrifluoroacetone,1-thenoyl-3,3,3-trifluoroacetone,.alpha.-thenoyltrifluoroacetone |
| IUPAC Name | 4,4,4-trifluoro-1-thiophen-2-ylbutane-1,3-dione |
| InChI Key | TXBBUSUXYMIVOS-UHFFFAOYSA-N |
| Molecular Formula | C8H5F3O2S |
Quinoline-4-carboxaldehyde, 97+%
CAS: 4363-93-3 Molecular Formula: C10H7NO Molecular Weight (g/mol): 157.17 MDL Number: MFCD00006781 InChI Key: MGCGJBXTNWUHQE-UHFFFAOYSA-N Synonym: 4-quinolinecarboxaldehyde,4-quinolinecarbaldehyde,cinchoninaldehyde,quinoline-4-carboxaldehyde,4-formylquinoline,unii-3a0k4yx051,chinolin-4-aldehyd,quinoline-4-aldehyde,4quinolinecarboxaldehyde PubChem CID: 78072 IUPAC Name: quinoline-4-carbaldehyde SMILES: O=CC1=C2C=CC=CC2=NC=C1
| PubChem CID | 78072 |
|---|---|
| CAS | 4363-93-3 |
| Molecular Weight (g/mol) | 157.17 |
| MDL Number | MFCD00006781 |
| SMILES | O=CC1=C2C=CC=CC2=NC=C1 |
| Synonym | 4-quinolinecarboxaldehyde,4-quinolinecarbaldehyde,cinchoninaldehyde,quinoline-4-carboxaldehyde,4-formylquinoline,unii-3a0k4yx051,chinolin-4-aldehyd,quinoline-4-aldehyde,4quinolinecarboxaldehyde |
| IUPAC Name | quinoline-4-carbaldehyde |
| InChI Key | MGCGJBXTNWUHQE-UHFFFAOYSA-N |
| Molecular Formula | C10H7NO |
3'-Hydroxyacetophenone, 98%
CAS: 121-71-1 Molecular Formula: C8H8O2 Molecular Weight (g/mol): 136.15 MDL Number: MFCD00002298 InChI Key: LUJMEECXHPYQOF-UHFFFAOYSA-N Synonym: 3'-hydroxyacetophenone,3-hydroxyacetophenone,1-3-hydroxyphenyl ethanone,m-hydroxyacetophenone,3-acetylphenol,1-3-hydroxyphenyl ethan-1-one,ethanone, 1-3-hydroxyphenyl,m-acetylphenol,3-hydroxy acetophenone,3-acetophenol PubChem CID: 8487 IUPAC Name: 1-(3-hydroxyphenyl)ethanone SMILES: CC(=O)C1=CC(=CC=C1)O
| PubChem CID | 8487 |
|---|---|
| CAS | 121-71-1 |
| Molecular Weight (g/mol) | 136.15 |
| MDL Number | MFCD00002298 |
| SMILES | CC(=O)C1=CC(=CC=C1)O |
| Synonym | 3'-hydroxyacetophenone,3-hydroxyacetophenone,1-3-hydroxyphenyl ethanone,m-hydroxyacetophenone,3-acetylphenol,1-3-hydroxyphenyl ethan-1-one,ethanone, 1-3-hydroxyphenyl,m-acetylphenol,3-hydroxy acetophenone,3-acetophenol |
| IUPAC Name | 1-(3-hydroxyphenyl)ethanone |
| InChI Key | LUJMEECXHPYQOF-UHFFFAOYSA-N |
| Molecular Formula | C8H8O2 |
m-Toluoylacetonitrile, 97%
CAS: 53882-81-8 Molecular Formula: C10H9NO Molecular Weight (g/mol): 159.188 MDL Number: MFCD00067922 InChI Key: IVLKDYOTZMFMLO-UHFFFAOYSA-N Synonym: 3-methylbenzoylacetonitrile,3-3-methylphenyl-3-oxopropanenitrile,3-toluoylacetonitrile,m-toluoylacetonitrile,3-oxo-3-m-tolyl propanenitrile,3-oxo-3-m-tolylpropanenitrile,pubchem12073,maybridge1_004502,acmc-1alb6,3-m-tolyl-3-oxo-propanenitrile PubChem CID: 143105 IUPAC Name: 3-(3-methylphenyl)-3-oxopropanenitrile SMILES: CC1=CC=CC(=C1)C(=O)CC#N
| PubChem CID | 143105 |
|---|---|
| CAS | 53882-81-8 |
| Molecular Weight (g/mol) | 159.188 |
| MDL Number | MFCD00067922 |
| SMILES | CC1=CC=CC(=C1)C(=O)CC#N |
| Synonym | 3-methylbenzoylacetonitrile,3-3-methylphenyl-3-oxopropanenitrile,3-toluoylacetonitrile,m-toluoylacetonitrile,3-oxo-3-m-tolyl propanenitrile,3-oxo-3-m-tolylpropanenitrile,pubchem12073,maybridge1_004502,acmc-1alb6,3-m-tolyl-3-oxo-propanenitrile |
| IUPAC Name | 3-(3-methylphenyl)-3-oxopropanenitrile |
| InChI Key | IVLKDYOTZMFMLO-UHFFFAOYSA-N |
| Molecular Formula | C10H9NO |
Diethylene glycol monobutyl ether, For surfactant analysis, ≥99.0%, MilliporeSigma™ Supelco™
MDL Number: MFCD00002881 Synonym: 2-(2-Butoxyethoxy)ethanol; BDG; Butyldiglycol
| MDL Number | MFCD00002881 |
|---|---|
| Synonym | 2-(2-Butoxyethoxy)ethanol; BDG; Butyldiglycol |
Benzoylacetonitrile, 98+%
CAS: 614-16-4 Molecular Formula: C9H7NO Molecular Weight (g/mol): 145.16 MDL Number: MFCD00001942 InChI Key: ZJRCIQAMTAINCB-UHFFFAOYSA-N Synonym: benzoylacetonitrile,2-cyanoacetophenone,phenacyl cyanide,3-oxo-3-phenyl-propionitrile,cyanomethyl phenyl ketone,acetonitrile, benzoyl,cyanoacetophenone,3-phenyl-3-ketopropionitrile,benzenepropanenitrile, beta-oxo,benzoyl acetonitrile PubChem CID: 64799 ChEBI: CHEBI:51855 IUPAC Name: 3-oxo-3-phenylpropanenitrile SMILES: O=C(CC#N)C1=CC=CC=C1
| PubChem CID | 64799 |
|---|---|
| CAS | 614-16-4 |
| Molecular Weight (g/mol) | 145.16 |
| ChEBI | CHEBI:51855 |
| MDL Number | MFCD00001942 |
| SMILES | O=C(CC#N)C1=CC=CC=C1 |
| Synonym | benzoylacetonitrile,2-cyanoacetophenone,phenacyl cyanide,3-oxo-3-phenyl-propionitrile,cyanomethyl phenyl ketone,acetonitrile, benzoyl,cyanoacetophenone,3-phenyl-3-ketopropionitrile,benzenepropanenitrile, beta-oxo,benzoyl acetonitrile |
| IUPAC Name | 3-oxo-3-phenylpropanenitrile |
| InChI Key | ZJRCIQAMTAINCB-UHFFFAOYSA-N |
| Molecular Formula | C9H7NO |
2-Butyn-1-ol, 98%
CAS: 764-01-2 Molecular Formula: C4H6O Molecular Weight (g/mol): 70.09 MDL Number: MFCD00002914 InChI Key: NEEDEQSZOUAJMU-UHFFFAOYSA-N Synonym: 2-butyn-1-ol,2-butynol,2-butyne-1-ol,hydroxymethylmethylacetylene,2-butynyl alcohol,1-hydroxybut-2-yne,2-butyn-l-ol,2-butyn1-ol,2-butin-1-ol,but-2-in-1-ol PubChem CID: 12991 IUPAC Name: but-2-yn-1-ol SMILES: CC#CCO
| PubChem CID | 12991 |
|---|---|
| CAS | 764-01-2 |
| Molecular Weight (g/mol) | 70.09 |
| MDL Number | MFCD00002914 |
| SMILES | CC#CCO |
| Synonym | 2-butyn-1-ol,2-butynol,2-butyne-1-ol,hydroxymethylmethylacetylene,2-butynyl alcohol,1-hydroxybut-2-yne,2-butyn-l-ol,2-butyn1-ol,2-butin-1-ol,but-2-in-1-ol |
| IUPAC Name | but-2-yn-1-ol |
| InChI Key | NEEDEQSZOUAJMU-UHFFFAOYSA-N |
| Molecular Formula | C4H6O |
3-Buten-1-ol, Spectrum™ Chemical
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CAS: 627-27-0
| CAS | 627-27-0 |
|---|
2,3-Dihydroxybenzaldehyde, 97%
CAS: 24677-78-9 Molecular Formula: C7H6O3 Molecular Weight (g/mol): 138.122 MDL Number: MFCD00003324 InChI Key: IXWOUPGDGMCKGT-UHFFFAOYSA-N Synonym: o-pyrocatechualdehyde,5,6-dihydroxybenzaldehyde,benzaldehyde, 2,3-dihydroxy,benzaldehyde, dihydroxy,2,3-dihydroxybenzaldehyde,dihydroxybenzaldehyde,pubchem6561,acmc-1clux,2,3-dihydroxy benzaldehyde,2,3-dihydroxy-benzaldehyde PubChem CID: 90579 ChEBI: CHEBI:50197 IUPAC Name: 2,3-dihydroxybenzaldehyde SMILES: C1=CC(=C(C(=C1)O)O)C=O
| PubChem CID | 90579 |
|---|---|
| CAS | 24677-78-9 |
| Molecular Weight (g/mol) | 138.122 |
| ChEBI | CHEBI:50197 |
| MDL Number | MFCD00003324 |
| SMILES | C1=CC(=C(C(=C1)O)O)C=O |
| Synonym | o-pyrocatechualdehyde,5,6-dihydroxybenzaldehyde,benzaldehyde, 2,3-dihydroxy,benzaldehyde, dihydroxy,2,3-dihydroxybenzaldehyde,dihydroxybenzaldehyde,pubchem6561,acmc-1clux,2,3-dihydroxy benzaldehyde,2,3-dihydroxy-benzaldehyde |
| IUPAC Name | 2,3-dihydroxybenzaldehyde |
| InChI Key | IXWOUPGDGMCKGT-UHFFFAOYSA-N |
| Molecular Formula | C7H6O3 |
2-Carboxybenzaldehyde, 98+%
CAS: 119-67-5 Molecular Formula: C8H6O3 Molecular Weight (g/mol): 150.133 MDL Number: MFCD00003336 InChI Key: DYNFCHNNOHNJFG-UHFFFAOYSA-N Synonym: 2-carboxybenzaldehyde,phthalaldehydic acid,o-formylbenzoic acid,benzoic acid, 2-formyl,o-carboxybenzaldehyde,benzoic acid, formyl,benzaldehyde-2-carboxylic acid,formylbenzoic acid,carboxybenzaldehyde,pubchem7365 PubChem CID: 8406 ChEBI: CHEBI:17605 IUPAC Name: 2-formylbenzoic acid SMILES: C1=CC=C(C(=C1)C=O)C(=O)O
| PubChem CID | 8406 |
|---|---|
| CAS | 119-67-5 |
| Molecular Weight (g/mol) | 150.133 |
| ChEBI | CHEBI:17605 |
| MDL Number | MFCD00003336 |
| SMILES | C1=CC=C(C(=C1)C=O)C(=O)O |
| Synonym | 2-carboxybenzaldehyde,phthalaldehydic acid,o-formylbenzoic acid,benzoic acid, 2-formyl,o-carboxybenzaldehyde,benzoic acid, formyl,benzaldehyde-2-carboxylic acid,formylbenzoic acid,carboxybenzaldehyde,pubchem7365 |
| IUPAC Name | 2-formylbenzoic acid |
| InChI Key | DYNFCHNNOHNJFG-UHFFFAOYSA-N |
| Molecular Formula | C8H6O3 |
p-Toluoylacetonitrile, 97%
CAS: 7391-28-8 Molecular Formula: C10H9NO Molecular Weight (g/mol): 159.19 MDL Number: MFCD00067895 InChI Key: AIECDYDQPCANJK-UHFFFAOYSA-N Synonym: 4-methylbenzoylacetonitrile,4-toluoylacetonitrile,3-4-methylphenyl-3-oxopropanenitrile,p-toluoylacetonitrile,3-oxo-3-p-tolyl propanenitrile,3-oxo-3-p-tolylpropanenitrile,acmc-20amdj,pubchem12072,maybridge1_004714,4-methyl-benzoylacetonitrile PubChem CID: 522513 IUPAC Name: 3-(4-methylphenyl)-3-oxopropanenitrile SMILES: CC1=CC=C(C=C1)C(=O)CC#N
| PubChem CID | 522513 |
|---|---|
| CAS | 7391-28-8 |
| Molecular Weight (g/mol) | 159.19 |
| MDL Number | MFCD00067895 |
| SMILES | CC1=CC=C(C=C1)C(=O)CC#N |
| Synonym | 4-methylbenzoylacetonitrile,4-toluoylacetonitrile,3-4-methylphenyl-3-oxopropanenitrile,p-toluoylacetonitrile,3-oxo-3-p-tolyl propanenitrile,3-oxo-3-p-tolylpropanenitrile,acmc-20amdj,pubchem12072,maybridge1_004714,4-methyl-benzoylacetonitrile |
| IUPAC Name | 3-(4-methylphenyl)-3-oxopropanenitrile |
| InChI Key | AIECDYDQPCANJK-UHFFFAOYSA-N |
| Molecular Formula | C10H9NO |
3,5-Diiodosalicylaldehyde, 98+%
CAS: 2631-77-8 Molecular Formula: C7H4I2O2 Molecular Weight (g/mol): 373.916 MDL Number: MFCD00003321 InChI Key: MYWSBJKVOUZCIA-UHFFFAOYSA-N PubChem CID: 75829 IUPAC Name: 2-hydroxy-3,5-diiodobenzaldehyde SMILES: C1=C(C=C(C(=C1I)O)C=O)I
| PubChem CID | 75829 |
|---|---|
| CAS | 2631-77-8 |
| Molecular Weight (g/mol) | 373.916 |
| MDL Number | MFCD00003321 |
| SMILES | C1=C(C=C(C(=C1I)O)C=O)I |
| IUPAC Name | 2-hydroxy-3,5-diiodobenzaldehyde |
| InChI Key | MYWSBJKVOUZCIA-UHFFFAOYSA-N |
| Molecular Formula | C7H4I2O2 |
5-Chlorosalicylaldehyde, 98%
CAS: 635-93-8 Molecular Formula: C7H5ClO2 Molecular Weight (g/mol): 156.57 MDL Number: MFCD00003331 InChI Key: FUGKCSRLAQKUHG-UHFFFAOYSA-N Synonym: 5-chlorosalicylaldehyde,2-hydroxy-5-chlorobenzaldehyde,benzaldehyde, 5-chloro-2-hydroxy,4-chloro-2-formylphenol,salicylaldehyde, 5-chloro,5-chloro-2-hydroxy-benzaldehyde,unii-4gcc8zkm3o,5-chloro-salicylaldehyde,4gcc8zkm3o,5-chloro-2-hydroxy benzaldehyde PubChem CID: 12481 IUPAC Name: 5-chloro-2-hydroxybenzaldehyde SMILES: OC1=CC=C(Cl)C=C1C=O
| PubChem CID | 12481 |
|---|---|
| CAS | 635-93-8 |
| Molecular Weight (g/mol) | 156.57 |
| MDL Number | MFCD00003331 |
| SMILES | OC1=CC=C(Cl)C=C1C=O |
| Synonym | 5-chlorosalicylaldehyde,2-hydroxy-5-chlorobenzaldehyde,benzaldehyde, 5-chloro-2-hydroxy,4-chloro-2-formylphenol,salicylaldehyde, 5-chloro,5-chloro-2-hydroxy-benzaldehyde,unii-4gcc8zkm3o,5-chloro-salicylaldehyde,4gcc8zkm3o,5-chloro-2-hydroxy benzaldehyde |
| IUPAC Name | 5-chloro-2-hydroxybenzaldehyde |
| InChI Key | FUGKCSRLAQKUHG-UHFFFAOYSA-N |
| Molecular Formula | C7H5ClO2 |