Organooxygen compounds
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4-Biphenylcarboxaldehyde, 99%
CAS: 3218-36-8 Molecular Formula: C13H10O Molecular Weight (g/mol): 182.22 MDL Number: MFCD00006947 InChI Key: ISDBWOPVZKNQDW-UHFFFAOYSA-N Synonym: 4-biphenylcarboxaldehyde,4-biphenylaldehyde,p-phenylbenzaldehyde,1,1'-biphenyl-4-carbaldehyde,biphenyl-4-carboxaldehyde,4-formylbiphenyl,p-biphenylylaldehyde,1,1'-biphenyl-4-carboxaldehyde,p-biphenylaldehyde,p-biphenylcarboxaldehyde PubChem CID: 76689 IUPAC Name: 4-phenylbenzaldehyde SMILES: O=CC1=CC=C(C=C1)C1=CC=CC=C1
| PubChem CID | 76689 |
|---|---|
| CAS | 3218-36-8 |
| Molecular Weight (g/mol) | 182.22 |
| MDL Number | MFCD00006947 |
| SMILES | O=CC1=CC=C(C=C1)C1=CC=CC=C1 |
| Synonym | 4-biphenylcarboxaldehyde,4-biphenylaldehyde,p-phenylbenzaldehyde,1,1'-biphenyl-4-carbaldehyde,biphenyl-4-carboxaldehyde,4-formylbiphenyl,p-biphenylylaldehyde,1,1'-biphenyl-4-carboxaldehyde,p-biphenylaldehyde,p-biphenylcarboxaldehyde |
| IUPAC Name | 4-phenylbenzaldehyde |
| InChI Key | ISDBWOPVZKNQDW-UHFFFAOYSA-N |
| Molecular Formula | C13H10O |
2-Bromo-3-pyridinecarboxaldehyde, 96%
CAS: 128071-75-0 Molecular Formula: C6H4BrNO Molecular Weight (g/mol): 186 MDL Number: MFCD04966945 InChI Key: GNFWMEFWZWXLIN-UHFFFAOYSA-N Synonym: 2-bromonicotinaldehyde,2-bromo-3-formylpyridine,2-bromo-3-pyridinecarboxaldehyde,2-bromopyridine-3-carboxaldehyde,3-pyridinecarboxaldehyde, 2-bromo,pubchem5057,acmc-1bypv,2-bromo-3-formyl pyridine,bromo-3-pyridine carbaldehyde,bromo-3-pyridinecarboxaldehyde PubChem CID: 4714951 IUPAC Name: 2-bromopyridine-3-carbaldehyde SMILES: C1=CC(=C(N=C1)Br)C=O
| PubChem CID | 4714951 |
|---|---|
| CAS | 128071-75-0 |
| Molecular Weight (g/mol) | 186 |
| MDL Number | MFCD04966945 |
| SMILES | C1=CC(=C(N=C1)Br)C=O |
| Synonym | 2-bromonicotinaldehyde,2-bromo-3-formylpyridine,2-bromo-3-pyridinecarboxaldehyde,2-bromopyridine-3-carboxaldehyde,3-pyridinecarboxaldehyde, 2-bromo,pubchem5057,acmc-1bypv,2-bromo-3-formyl pyridine,bromo-3-pyridine carbaldehyde,bromo-3-pyridinecarboxaldehyde |
| IUPAC Name | 2-bromopyridine-3-carbaldehyde |
| InChI Key | GNFWMEFWZWXLIN-UHFFFAOYSA-N |
| Molecular Formula | C6H4BrNO |
1,3-Dimethyl-1H-pyrazole-5-carbaldehyde, ≥90%, Thermo Scientific™
CAS: 25016-09-5 Molecular Formula: C6H8N2O Molecular Weight (g/mol): 124.143 MDL Number: MFCD02681907 InChI Key: JWYFGNVBKRJGTN-UHFFFAOYSA-N PubChem CID: 2776362 IUPAC Name: 2,5-dimethylpyrazole-3-carbaldehyde SMILES: CC1=NN(C(=C1)C=O)C
| PubChem CID | 2776362 |
|---|---|
| CAS | 25016-09-5 |
| Molecular Weight (g/mol) | 124.143 |
| MDL Number | MFCD02681907 |
| SMILES | CC1=NN(C(=C1)C=O)C |
| IUPAC Name | 2,5-dimethylpyrazole-3-carbaldehyde |
| InChI Key | JWYFGNVBKRJGTN-UHFFFAOYSA-N |
| Molecular Formula | C6H8N2O |
2,4-Dihydroxybenzaldehyde, 98%
CAS: 95-01-2 Molecular Formula: C7H6O3 Molecular Weight (g/mol): 138.12 MDL Number: MFCD00011686 InChI Key: IUNJCFABHJZSKB-UHFFFAOYSA-N Synonym: beta-resorcylaldehyde,4-hydroxysalicylaldehyde,4-formylresorcinol,beta-resorcaldehyde,benzaldehyde, 2,4-dihydroxy,beta-resorcinaldehyde,beta-resorcylic aldehyde,2,4-dihydroxybenzenecarbonal,salicylaldehyde, 4-hydroxy,4-hydroxysalicyladehyde PubChem CID: 7213 ChEBI: CHEBI:50198 IUPAC Name: 2,4-dihydroxybenzaldehyde SMILES: OC1=CC=C(C=O)C(O)=C1
| PubChem CID | 7213 |
|---|---|
| CAS | 95-01-2 |
| Molecular Weight (g/mol) | 138.12 |
| ChEBI | CHEBI:50198 |
| MDL Number | MFCD00011686 |
| SMILES | OC1=CC=C(C=O)C(O)=C1 |
| Synonym | beta-resorcylaldehyde,4-hydroxysalicylaldehyde,4-formylresorcinol,beta-resorcaldehyde,benzaldehyde, 2,4-dihydroxy,beta-resorcinaldehyde,beta-resorcylic aldehyde,2,4-dihydroxybenzenecarbonal,salicylaldehyde, 4-hydroxy,4-hydroxysalicyladehyde |
| IUPAC Name | 2,4-dihydroxybenzaldehyde |
| InChI Key | IUNJCFABHJZSKB-UHFFFAOYSA-N |
| Molecular Formula | C7H6O3 |
Tetramethyl orthocarbonate, 95%
CAS: 1850-14-2 Molecular Formula: C5H12O4 Molecular Weight (g/mol): 136.147 MDL Number: MFCD00008473 InChI Key: AHJWSRRHTXRLAQ-UHFFFAOYSA-N Synonym: tetramethyl orthocarbonate,methane, tetramethoxy,orthocarbonic acid tetramethyl ester,tetramethoxy-methane,tetramethylorthocarbonate,acmc-209emf,tetramethyl ortho carbonate,tetramethyl orthocarbonate, purum gc PubChem CID: 74613 IUPAC Name: tetramethoxymethane SMILES: COC(OC)(OC)OC
| PubChem CID | 74613 |
|---|---|
| CAS | 1850-14-2 |
| Molecular Weight (g/mol) | 136.147 |
| MDL Number | MFCD00008473 |
| SMILES | COC(OC)(OC)OC |
| Synonym | tetramethyl orthocarbonate,methane, tetramethoxy,orthocarbonic acid tetramethyl ester,tetramethoxy-methane,tetramethylorthocarbonate,acmc-209emf,tetramethyl ortho carbonate,tetramethyl orthocarbonate, purum gc |
| IUPAC Name | tetramethoxymethane |
| InChI Key | AHJWSRRHTXRLAQ-UHFFFAOYSA-N |
| Molecular Formula | C5H12O4 |
3,4-Dichlorophenethyl alcohol, 97%
CAS: 35364-79-5 Molecular Formula: C8H8Cl2O Molecular Weight (g/mol): 191.051 MDL Number: MFCD00800673 InChI Key: GITOMJDYNUMCOV-UHFFFAOYSA-N Synonym: 2-3,4-dichlorophenyl ethanol,3,4-dichlorophenethyl alcohol,3,4-dichlorophenethylalcohol,2-3,4-dichlorophenyl ethan-1-ol,benzeneethanol, 3,4-dichloro,2-3,4-dichlorophenyl-ethanol,3,4-dichlorobenzeneethanol,benzeneethanol,3,4-dichloro,acmc-1adlk,2-3,4-dichloro-phenyl-ethanol PubChem CID: 244558 IUPAC Name: 2-(3,4-dichlorophenyl)ethanol SMILES: C1=CC(=C(C=C1CCO)Cl)Cl
| PubChem CID | 244558 |
|---|---|
| CAS | 35364-79-5 |
| Molecular Weight (g/mol) | 191.051 |
| MDL Number | MFCD00800673 |
| SMILES | C1=CC(=C(C=C1CCO)Cl)Cl |
| Synonym | 2-3,4-dichlorophenyl ethanol,3,4-dichlorophenethyl alcohol,3,4-dichlorophenethylalcohol,2-3,4-dichlorophenyl ethan-1-ol,benzeneethanol, 3,4-dichloro,2-3,4-dichlorophenyl-ethanol,3,4-dichlorobenzeneethanol,benzeneethanol,3,4-dichloro,acmc-1adlk,2-3,4-dichloro-phenyl-ethanol |
| IUPAC Name | 2-(3,4-dichlorophenyl)ethanol |
| InChI Key | GITOMJDYNUMCOV-UHFFFAOYSA-N |
| Molecular Formula | C8H8Cl2O |
3-Ethyl-3-hexanol, 98%, Thermo Scientific Chemicals
CAS: 597-76-2 Molecular Formula: C8H18O Molecular Weight (g/mol): 130.23 MDL Number: MFCD00039616 InChI Key: WNDLTOTUHMHNOC-UHFFFAOYSA-N Synonym: 3-ethyl-3-hexanol,3-hexanol, 3-ethyl,1,1-diethyl-1-butanol,diethyl n-propyl carbinol,acmc-1ak6h PubChem CID: 69008 IUPAC Name: 3-ethylhexan-3-ol SMILES: CCCC(O)(CC)CC
| PubChem CID | 69008 |
|---|---|
| CAS | 597-76-2 |
| Molecular Weight (g/mol) | 130.23 |
| MDL Number | MFCD00039616 |
| SMILES | CCCC(O)(CC)CC |
| Synonym | 3-ethyl-3-hexanol,3-hexanol, 3-ethyl,1,1-diethyl-1-butanol,diethyl n-propyl carbinol,acmc-1ak6h |
| IUPAC Name | 3-ethylhexan-3-ol |
| InChI Key | WNDLTOTUHMHNOC-UHFFFAOYSA-N |
| Molecular Formula | C8H18O |
3',5'-Di-tert-butyl-4'-hydroxyacetophenone, 98%
CAS: 14035-33-7 Molecular Formula: C16H24O2 Molecular Weight (g/mol): 248.37 MDL Number: MFCD00017520 InChI Key: WGJPGMJLARWHRK-UHFFFAOYSA-N Synonym: 1-3,5-di-tert-butyl-4-hydroxyphenyl ethanone,1-3,5-ditert-butyl-4-hydroxyphenyl ethanone,1-3,5-di tert-butyl-4-hydroxyphenyl ethan-1-one,3',5'-di-tert-butyl-4'-hydroxyacetophenone,3,5-di-tert-butyl-4-hydroxyacetophenone,1-3,5-di-tert-butyl-4-hydroxyphenyl ethan-1-one,ethanone, 1-3,5-bis 1,1-dimethylethyl-4-hydroxyphenyl,1-3,5-bis 1,1-dimethylethyl-4-hydroxyphenyl ethanone,1-acetyl-3,5-bis tert-butyl-4-hydroxybenzene,cbmicro_019190 PubChem CID: 616296 IUPAC Name: 1-(3,5-ditert-butyl-4-hydroxyphenyl)ethanone SMILES: CC(=O)C1=CC(=C(O)C(=C1)C(C)(C)C)C(C)(C)C
| PubChem CID | 616296 |
|---|---|
| CAS | 14035-33-7 |
| Molecular Weight (g/mol) | 248.37 |
| MDL Number | MFCD00017520 |
| SMILES | CC(=O)C1=CC(=C(O)C(=C1)C(C)(C)C)C(C)(C)C |
| Synonym | 1-3,5-di-tert-butyl-4-hydroxyphenyl ethanone,1-3,5-ditert-butyl-4-hydroxyphenyl ethanone,1-3,5-di tert-butyl-4-hydroxyphenyl ethan-1-one,3',5'-di-tert-butyl-4'-hydroxyacetophenone,3,5-di-tert-butyl-4-hydroxyacetophenone,1-3,5-di-tert-butyl-4-hydroxyphenyl ethan-1-one,ethanone, 1-3,5-bis 1,1-dimethylethyl-4-hydroxyphenyl,1-3,5-bis 1,1-dimethylethyl-4-hydroxyphenyl ethanone,1-acetyl-3,5-bis tert-butyl-4-hydroxybenzene,cbmicro_019190 |
| IUPAC Name | 1-(3,5-ditert-butyl-4-hydroxyphenyl)ethanone |
| InChI Key | WGJPGMJLARWHRK-UHFFFAOYSA-N |
| Molecular Formula | C16H24O2 |
3-Aminopyridine-4-carboxaldehyde, 95%, Thermo Scientific Chemicals
CAS: 55279-29-3 Molecular Formula: C6H6N2O Molecular Weight (g/mol): 122.13 MDL Number: MFCD06410684 InChI Key: NDEGFXFYOKVWAK-UHFFFAOYSA-N Synonym: 3-aminoisonicotinaldehyde,3-aminopyridine-4-carboxaldehyde,3-amino-pyridine-4-carbaldehyde,3-amino-4-pyridinecarboxaldehyde,3-amino-4-formylpyridine,3-amino-4-carboxaldehyde,4-pyridinecarboxaldehyde, 3-amino,acmc-1b1xn,3-amino-4-pyridine carboxaldehyde,4-pyridinecarboxaldehyde,3-amino PubChem CID: 2763001 IUPAC Name: 3-aminopyridine-4-carbaldehyde SMILES: NC1=CN=CC=C1C=O
| PubChem CID | 2763001 |
|---|---|
| CAS | 55279-29-3 |
| Molecular Weight (g/mol) | 122.13 |
| MDL Number | MFCD06410684 |
| SMILES | NC1=CN=CC=C1C=O |
| Synonym | 3-aminoisonicotinaldehyde,3-aminopyridine-4-carboxaldehyde,3-amino-pyridine-4-carbaldehyde,3-amino-4-pyridinecarboxaldehyde,3-amino-4-formylpyridine,3-amino-4-carboxaldehyde,4-pyridinecarboxaldehyde, 3-amino,acmc-1b1xn,3-amino-4-pyridine carboxaldehyde,4-pyridinecarboxaldehyde,3-amino |
| IUPAC Name | 3-aminopyridine-4-carbaldehyde |
| InChI Key | NDEGFXFYOKVWAK-UHFFFAOYSA-N |
| Molecular Formula | C6H6N2O |
2-Quinolinecarboxaldehyde, 97%
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
| PubChem CID | 79619 |
|---|---|
| CAS | 5470-96-2 |
| Molecular Weight (g/mol) | 157.17 |
| MDL Number | MFCD00075032 |
| SMILES | O=CC1=CC=C2C=CC=CC2=N1 |
| Synonym | 2-quinolinecarboxaldehyde,quinoline-2-carboxaldehyde,2-quinolinecarbaldehyde,2-formylquinoline,quinaldaldehyde,quinolinecarboxaldehyde,quinoline aldehyde,quinoline-2-aldehyde,zlchem 599,pubchem2277 |
| IUPAC Name | quinoline-2-carbaldehyde |
| InChI Key | WPYJKGWLDJECQD-UHFFFAOYSA-N |
| Molecular Formula | C10H7NO |
2-Adamantanol, 98%
CAS: 700-57-2 Molecular Formula: C10H16O Molecular Weight (g/mol): 152.24 MDL Number: MFCD00074744 InChI Key: FOWDOWQYRZXQDP-UHFFFAOYSA-N Synonym: 2-adamantanol,2-hydroxyadamantane,tricyclo 3.3.1.13,7 decan-2-ol,tricyclo 3.3.1.1∼3,7∼ decan-2-ol,1r,3r,5r,7r-adamantan-2-ol,1-adamantanol;,2alpha-adamantanol,pubchem8753 PubChem CID: 64149 IUPAC Name: adamantan-2-ol SMILES: C1C2CC3CC1CC(C2)C3O
| PubChem CID | 64149 |
|---|---|
| CAS | 700-57-2 |
| Molecular Weight (g/mol) | 152.24 |
| MDL Number | MFCD00074744 |
| SMILES | C1C2CC3CC1CC(C2)C3O |
| Synonym | 2-adamantanol,2-hydroxyadamantane,tricyclo 3.3.1.13,7 decan-2-ol,tricyclo 3.3.1.1∼3,7∼ decan-2-ol,1r,3r,5r,7r-adamantan-2-ol,1-adamantanol;,2alpha-adamantanol,pubchem8753 |
| IUPAC Name | adamantan-2-ol |
| InChI Key | FOWDOWQYRZXQDP-UHFFFAOYSA-N |
| Molecular Formula | C10H16O |
3-Chlorobenzoylacetonitrile, 98%
CAS: 21667-62-9 Molecular Formula: C9H6ClNO Molecular Weight (g/mol): 179.60 MDL Number: MFCD00067891 InChI Key: IUDFNNHFARLIPF-UHFFFAOYSA-N Synonym: 3-chlorobenzoylacetonitrile,3-3-chlorophenyl-3-oxopropanenitrile,3-chlorophenacylcyanide,3-chlorobenzoyl acetonitrile,3-3-chlorophenyl-3-oxo-propanenitrile,beta-ketonitrile 5b,pubchem12046,m-chlorophenacyl cyanide,acmc-1cqmb,maybridge1_004670 PubChem CID: 140855 IUPAC Name: 3-(3-chlorophenyl)-3-oxopropanenitrile SMILES: ClC1=CC=CC(=C1)C(=O)CC#N
| PubChem CID | 140855 |
|---|---|
| CAS | 21667-62-9 |
| Molecular Weight (g/mol) | 179.60 |
| MDL Number | MFCD00067891 |
| SMILES | ClC1=CC=CC(=C1)C(=O)CC#N |
| Synonym | 3-chlorobenzoylacetonitrile,3-3-chlorophenyl-3-oxopropanenitrile,3-chlorophenacylcyanide,3-chlorobenzoyl acetonitrile,3-3-chlorophenyl-3-oxo-propanenitrile,beta-ketonitrile 5b,pubchem12046,m-chlorophenacyl cyanide,acmc-1cqmb,maybridge1_004670 |
| IUPAC Name | 3-(3-chlorophenyl)-3-oxopropanenitrile |
| InChI Key | IUDFNNHFARLIPF-UHFFFAOYSA-N |
| Molecular Formula | C9H6ClNO |
2-Bromoacetophenone, 98%
CAS: 70-11-1 Molecular Formula: C8H7BrO Molecular Weight (g/mol): 199.047 MDL Number: MFCD00000195 InChI Key: LIGACIXOYTUXAW-UHFFFAOYSA-N Synonym: 2-bromoacetophenone,phenacyl bromide,2-bromo-1-phenylethan-1-one,bromoacetophenone,ethanone, 2-bromo-1-phenyl,bromomethyl phenyl ketone,alpha-bromoacetophenone,stauffer 4644,omega-bromoacetophenone,acetophenone, 2-bromo PubChem CID: 6259 ChEBI: CHEBI:51846 IUPAC Name: 2-bromo-1-phenylethanone SMILES: C1=CC=C(C=C1)C(=O)CBr
| PubChem CID | 6259 |
|---|---|
| CAS | 70-11-1 |
| Molecular Weight (g/mol) | 199.047 |
| ChEBI | CHEBI:51846 |
| MDL Number | MFCD00000195 |
| SMILES | C1=CC=C(C=C1)C(=O)CBr |
| Synonym | 2-bromoacetophenone,phenacyl bromide,2-bromo-1-phenylethan-1-one,bromoacetophenone,ethanone, 2-bromo-1-phenyl,bromomethyl phenyl ketone,alpha-bromoacetophenone,stauffer 4644,omega-bromoacetophenone,acetophenone, 2-bromo |
| IUPAC Name | 2-bromo-1-phenylethanone |
| InChI Key | LIGACIXOYTUXAW-UHFFFAOYSA-N |
| Molecular Formula | C8H7BrO |
2-(2-n-Butoxyethoxy)ethyl acetate, 98%
CAS: 124-17-4 Molecular Formula: C10H20O4 Molecular Weight (g/mol): 204.266 MDL Number: MFCD00009458 InChI Key: VXQBJTKSVGFQOL-UHFFFAOYSA-N Synonym: 2-2-butoxyethoxy ethyl acetate,butoxyethoxyethyl acetate,diethylene glycol monobutyl ether acetate,butyl diglycol acetate,butyl carbitol acetate,ektasolve db acetate,2-2-butoxyethoxy ethanol acetate,butyl diethylene glycol acetate,butylkarbitolacetat,diglycol monobutyl ether acetate PubChem CID: 31288 IUPAC Name: 2-(2-butoxyethoxy)ethyl acetate SMILES: CCCCOCCOCCOC(=O)C
| PubChem CID | 31288 |
|---|---|
| CAS | 124-17-4 |
| Molecular Weight (g/mol) | 204.266 |
| MDL Number | MFCD00009458 |
| SMILES | CCCCOCCOCCOC(=O)C |
| Synonym | 2-2-butoxyethoxy ethyl acetate,butoxyethoxyethyl acetate,diethylene glycol monobutyl ether acetate,butyl diglycol acetate,butyl carbitol acetate,ektasolve db acetate,2-2-butoxyethoxy ethanol acetate,butyl diethylene glycol acetate,butylkarbitolacetat,diglycol monobutyl ether acetate |
| IUPAC Name | 2-(2-butoxyethoxy)ethyl acetate |
| InChI Key | VXQBJTKSVGFQOL-UHFFFAOYSA-N |
| Molecular Formula | C10H20O4 |
cis-2-Butene-1,4-diol, 97%
CAS: 6117-80-2 Molecular Formula: C4H8O2 Molecular Weight (g/mol): 88.11 MDL Number: MFCD00002924,MFCD00063207 InChI Key: ORTVZLZNOYNASJ-UPHRSURJSA-N Synonym: cis-2-butene-1,4-diol,z-2-butene-1,4-diol,cis-butenediol,unii-za7vgu6scv,cis-1,4-dihydroxy-2-butene,z-but-2-ene-1,4-diol,2-butene-1,4-diol,2z-but-2-ene-1,4-diol,2-butene-1,4-diol, z,za7vgu6scv PubChem CID: 643790 SMILES: OC\C=C/CO
| PubChem CID | 643790 |
|---|---|
| CAS | 6117-80-2 |
| Molecular Weight (g/mol) | 88.11 |
| MDL Number | MFCD00002924,MFCD00063207 |
| SMILES | OC\C=C/CO |
| Synonym | cis-2-butene-1,4-diol,z-2-butene-1,4-diol,cis-butenediol,unii-za7vgu6scv,cis-1,4-dihydroxy-2-butene,z-but-2-ene-1,4-diol,2-butene-1,4-diol,2z-but-2-ene-1,4-diol,2-butene-1,4-diol, z,za7vgu6scv |
| InChI Key | ORTVZLZNOYNASJ-UPHRSURJSA-N |
| Molecular Formula | C4H8O2 |