Organooxygen compounds
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4-(2-Aminoethyl)morpholine, 98+%
CAS: 2038-03-1 Molecular Formula: C6H14N2O Molecular Weight (g/mol): 130.19 MDL Number: MFCD00006182 InChI Key: RWIVICVCHVMHMU-UHFFFAOYSA-N Synonym: 4-2-aminoethyl morpholine,2-morpholinoethanamine,4-morpholineethanamine,2-morpholinoethylamine,n-aminoethylmorpholine,2-morpholin-4-yl ethan-1-amine,morpholine, 4-2-aminoethyl,n-2-aminoethyl morpholine,n-2-aminoethylmorpholine,2-morpholin-4-ylethylamine PubChem CID: 408285 IUPAC Name: 2-morpholin-4-ylethanamine SMILES: C1COCCN1CCN
| PubChem CID | 408285 |
|---|---|
| CAS | 2038-03-1 |
| Molecular Weight (g/mol) | 130.19 |
| MDL Number | MFCD00006182 |
| SMILES | C1COCCN1CCN |
| Synonym | 4-2-aminoethyl morpholine,2-morpholinoethanamine,4-morpholineethanamine,2-morpholinoethylamine,n-aminoethylmorpholine,2-morpholin-4-yl ethan-1-amine,morpholine, 4-2-aminoethyl,n-2-aminoethyl morpholine,n-2-aminoethylmorpholine,2-morpholin-4-ylethylamine |
| IUPAC Name | 2-morpholin-4-ylethanamine |
| InChI Key | RWIVICVCHVMHMU-UHFFFAOYSA-N |
| Molecular Formula | C6H14N2O |
5-Methoxy-2-methylindole, 99+%
CAS: 1076-74-0 Molecular Formula: C10H11NO Molecular Weight (g/mol): 161.20 MDL Number: MFCD00005620 InChI Key: VSWGLJOQFUMFOQ-UHFFFAOYSA-N Synonym: 5-methoxy-2-methylindole,2-methyl-5-methoxyindole,1h-indole, 5-methoxy-2-methyl,indole, 5-methoxy-2-methyl,pubchem7236,acmc-1buiu,maybridge1_002343,5-methoxy-2 methylindole,2-methyl-5-methoxylindole,2-methyl-5-methoxy indole PubChem CID: 70642 IUPAC Name: 5-methoxy-2-methyl-1H-indole SMILES: COC1=CC=C2NC(C)=CC2=C1
| PubChem CID | 70642 |
|---|---|
| CAS | 1076-74-0 |
| Molecular Weight (g/mol) | 161.20 |
| MDL Number | MFCD00005620 |
| SMILES | COC1=CC=C2NC(C)=CC2=C1 |
| Synonym | 5-methoxy-2-methylindole,2-methyl-5-methoxyindole,1h-indole, 5-methoxy-2-methyl,indole, 5-methoxy-2-methyl,pubchem7236,acmc-1buiu,maybridge1_002343,5-methoxy-2 methylindole,2-methyl-5-methoxylindole,2-methyl-5-methoxy indole |
| IUPAC Name | 5-methoxy-2-methyl-1H-indole |
| InChI Key | VSWGLJOQFUMFOQ-UHFFFAOYSA-N |
| Molecular Formula | C10H11NO |
4-Acetyldiphenyl sulfone, 98%
CAS: 65085-83-8 Molecular Formula: C14H12O3S Molecular Weight (g/mol): 260.307 MDL Number: MFCD00209628 InChI Key: FGFHDNIGKVTTLC-UHFFFAOYSA-N Synonym: 4-acetyldiphenyl sulfone,1-4-phenylsulfonyl phenyl ethanone,1-4-benzenesulfonyl phenyl ethanone,4-acetyl diphenyl sulfone,1-4-phenylsulfonyl phenyl ethan-1-one,pubchem15334,4-acetyldiphenylsulfone,4-phenylsulfonyl acetophenone,phenyl 4-acetylphenyl sulfone PubChem CID: 265878 IUPAC Name: 1-[4-(benzenesulfonyl)phenyl]ethanone SMILES: CC(=O)C1=CC=C(C=C1)S(=O)(=O)C2=CC=CC=C2
| PubChem CID | 265878 |
|---|---|
| CAS | 65085-83-8 |
| Molecular Weight (g/mol) | 260.307 |
| MDL Number | MFCD00209628 |
| SMILES | CC(=O)C1=CC=C(C=C1)S(=O)(=O)C2=CC=CC=C2 |
| Synonym | 4-acetyldiphenyl sulfone,1-4-phenylsulfonyl phenyl ethanone,1-4-benzenesulfonyl phenyl ethanone,4-acetyl diphenyl sulfone,1-4-phenylsulfonyl phenyl ethan-1-one,pubchem15334,4-acetyldiphenylsulfone,4-phenylsulfonyl acetophenone,phenyl 4-acetylphenyl sulfone |
| IUPAC Name | 1-[4-(benzenesulfonyl)phenyl]ethanone |
| InChI Key | FGFHDNIGKVTTLC-UHFFFAOYSA-N |
| Molecular Formula | C14H12O3S |
3-Chloro-4-hydroxybenzaldehyde, 98%
CAS: 2420-16-8 Molecular Formula: C7H5ClO2 Molecular Weight (g/mol): 156.57 MDL Number: MFCD00016981 InChI Key: VGSOCYWCRMXQAB-UHFFFAOYSA-N Synonym: benzaldehyde, 3-chloro-4-hydroxy,4-hydroxy-3-chlorobenzaldehyde,3-chloro-4-hydroxy-benzaldehyde,benzaldehyde, 3-chloro-4-hydroxy-8ci 9ci,pubchem7764,acmc-1crqk,3-chlor-4-hydroxybenzaldehyde,5-chloro-4-hyroxybenzaldehyde,5-chloro-4-hydroxybenzaldehyde,3-chloro-4-hydroxy benzaldehyde PubChem CID: 17022 IUPAC Name: 3-chloro-4-hydroxybenzaldehyde SMILES: OC1=CC=C(C=O)C=C1Cl
| PubChem CID | 17022 |
|---|---|
| CAS | 2420-16-8 |
| Molecular Weight (g/mol) | 156.57 |
| MDL Number | MFCD00016981 |
| SMILES | OC1=CC=C(C=O)C=C1Cl |
| Synonym | benzaldehyde, 3-chloro-4-hydroxy,4-hydroxy-3-chlorobenzaldehyde,3-chloro-4-hydroxy-benzaldehyde,benzaldehyde, 3-chloro-4-hydroxy-8ci 9ci,pubchem7764,acmc-1crqk,3-chlor-4-hydroxybenzaldehyde,5-chloro-4-hyroxybenzaldehyde,5-chloro-4-hydroxybenzaldehyde,3-chloro-4-hydroxy benzaldehyde |
| IUPAC Name | 3-chloro-4-hydroxybenzaldehyde |
| InChI Key | VGSOCYWCRMXQAB-UHFFFAOYSA-N |
| Molecular Formula | C7H5ClO2 |
trans-4-Methylcyclohexanol, 98%
CAS: 7731-29-5 Molecular Formula: C7H14O Molecular Weight (g/mol): 114.188 MDL Number: MFCD00064171 InChI Key: MQWCXKGKQLNYQG-UHFFFAOYSA-N Synonym: 4-methylcyclohexanol,trans-4-methylcyclohexanol,cis-4-methylcyclohexanol,cyclohexanol, 4-methyl,1-methyl-4-cyclohexanol,cyclohexanol, 4-methyl-, trans,methyl cyclohexanol,p-methylcyclohexanol,cyclohexanol, 4-methyl-, cis,trans 4-methyl cyclohexanol PubChem CID: 11524 IUPAC Name: 4-methylcyclohexan-1-ol SMILES: CC1CCC(CC1)O
| PubChem CID | 11524 |
|---|---|
| CAS | 7731-29-5 |
| Molecular Weight (g/mol) | 114.188 |
| MDL Number | MFCD00064171 |
| SMILES | CC1CCC(CC1)O |
| Synonym | 4-methylcyclohexanol,trans-4-methylcyclohexanol,cis-4-methylcyclohexanol,cyclohexanol, 4-methyl,1-methyl-4-cyclohexanol,cyclohexanol, 4-methyl-, trans,methyl cyclohexanol,p-methylcyclohexanol,cyclohexanol, 4-methyl-, cis,trans 4-methyl cyclohexanol |
| IUPAC Name | 4-methylcyclohexan-1-ol |
| InChI Key | MQWCXKGKQLNYQG-UHFFFAOYSA-N |
| Molecular Formula | C7H14O |
Isoquinoline-5-carboxaldehyde, 97%
CAS: 80278-67-7 Molecular Formula: C10H7NO Molecular Weight (g/mol): 157.172 MDL Number: MFCD03412483 InChI Key: ILRSABOCKMOFGW-UHFFFAOYSA-N Synonym: 5-isoquinolinecarboxaldehyde,isoquinoline-5-carboxaldehyde,5-formylisoquinoline,ksc447q7n,5-isoquinolinecarbaldehyde,5-isoquinolinecarboxaldehyde 6ci,9ci PubChem CID: 7016853 IUPAC Name: isoquinoline-5-carbaldehyde SMILES: C1=CC2=C(C=CN=C2)C(=C1)C=O
| PubChem CID | 7016853 |
|---|---|
| CAS | 80278-67-7 |
| Molecular Weight (g/mol) | 157.172 |
| MDL Number | MFCD03412483 |
| SMILES | C1=CC2=C(C=CN=C2)C(=C1)C=O |
| Synonym | 5-isoquinolinecarboxaldehyde,isoquinoline-5-carboxaldehyde,5-formylisoquinoline,ksc447q7n,5-isoquinolinecarbaldehyde,5-isoquinolinecarboxaldehyde 6ci,9ci |
| IUPAC Name | isoquinoline-5-carbaldehyde |
| InChI Key | ILRSABOCKMOFGW-UHFFFAOYSA-N |
| Molecular Formula | C10H7NO |
1-Phenylcyclohexanol, 97%
CAS: 1589-60-2 Molecular Formula: C12H16O Molecular Weight (g/mol): 176.259 MDL Number: MFCD00021393 InChI Key: DTTDXHDYTWQDCS-UHFFFAOYSA-N Synonym: 1-phenylcyclohexanol,cyclohexanol, 1-phenyl,1-phenyl-1-cyclohexanol,phenylcyclohexanol,cyclohexanol, phenyl,1-phenylcyclohexanol-1,1-phenyl-cyclohexanol,maybridge1_002485,1-phenyl-cyclohexan-1-ol,acmc-209dj8 PubChem CID: 15319 IUPAC Name: 1-phenylcyclohexan-1-ol SMILES: C1CCC(CC1)(C2=CC=CC=C2)O
| PubChem CID | 15319 |
|---|---|
| CAS | 1589-60-2 |
| Molecular Weight (g/mol) | 176.259 |
| MDL Number | MFCD00021393 |
| SMILES | C1CCC(CC1)(C2=CC=CC=C2)O |
| Synonym | 1-phenylcyclohexanol,cyclohexanol, 1-phenyl,1-phenyl-1-cyclohexanol,phenylcyclohexanol,cyclohexanol, phenyl,1-phenylcyclohexanol-1,1-phenyl-cyclohexanol,maybridge1_002485,1-phenyl-cyclohexan-1-ol,acmc-209dj8 |
| IUPAC Name | 1-phenylcyclohexan-1-ol |
| InChI Key | DTTDXHDYTWQDCS-UHFFFAOYSA-N |
| Molecular Formula | C12H16O |
3,4-Hexanedione, 94%
CAS: 4437-51-8 Molecular Formula: C6H10O2 Molecular Weight (g/mol): 114.144 MDL Number: MFCD00010237 InChI Key: KVFQMAZOBTXCAZ-UHFFFAOYSA-N Synonym: 3,4-hexanedione,bipropionyl,dipropionyl,diethyl diketone,3,4-hexane dione,unii-4m4npr5vgd,3,4-hexandione,fema no. 3168,ccris 6295,4m4npr5vgd PubChem CID: 62539 IUPAC Name: hexane-3,4-dione SMILES: CCC(=O)C(=O)CC
| PubChem CID | 62539 |
|---|---|
| CAS | 4437-51-8 |
| Molecular Weight (g/mol) | 114.144 |
| MDL Number | MFCD00010237 |
| SMILES | CCC(=O)C(=O)CC |
| Synonym | 3,4-hexanedione,bipropionyl,dipropionyl,diethyl diketone,3,4-hexane dione,unii-4m4npr5vgd,3,4-hexandione,fema no. 3168,ccris 6295,4m4npr5vgd |
| IUPAC Name | hexane-3,4-dione |
| InChI Key | KVFQMAZOBTXCAZ-UHFFFAOYSA-N |
| Molecular Formula | C6H10O2 |
5-Ethyl-2-furaldehyde, 98%
CAS: 23074-10-4 Molecular Formula: C7H8O2 Molecular Weight (g/mol): 124.14 MDL Number: MFCD00030605 InChI Key: XADGZBXFWQHBDB-UHFFFAOYSA-N PubChem CID: 89989 IUPAC Name: 5-ethylfuran-2-carbaldehyde SMILES: CCC1=CC=C(O1)C=O
| PubChem CID | 89989 |
|---|---|
| CAS | 23074-10-4 |
| Molecular Weight (g/mol) | 124.14 |
| MDL Number | MFCD00030605 |
| SMILES | CCC1=CC=C(O1)C=O |
| IUPAC Name | 5-ethylfuran-2-carbaldehyde |
| InChI Key | XADGZBXFWQHBDB-UHFFFAOYSA-N |
| Molecular Formula | C7H8O2 |
1-Methyl-1H-pyrazole-5-carbaldehyde, 97%, Thermo Scientific™
CAS: 27258-33-9 Molecular Formula: C5H6N2O Molecular Weight (g/mol): 110.12 MDL Number: MFCD03419801 InChI Key: RAJRANFZSWDUJZ-UHFFFAOYSA-N Synonym: 1-methyl-1h-pyrazole-5-carbaldehyde,2-methyl-2h-pyrazole-3-carbaldehyde,5-formyl-1-methyl-1h-pyrazole,1-methylpyrazole-5-carboxaldehyde,5-formyl-1-methylpyrazole,1-methylpyrazole-5-carbaldehyde,1h-pyrazole-5-carboxaldehyde, 1-methyl,1-methyl-1h-pyrazole-5-carboxaldehyde,pubchem16289,acmc-209gw7 PubChem CID: 7019414 IUPAC Name: 2-methylpyrazole-3-carbaldehyde SMILES: CN1N=CC=C1C=O
| PubChem CID | 7019414 |
|---|---|
| CAS | 27258-33-9 |
| Molecular Weight (g/mol) | 110.12 |
| MDL Number | MFCD03419801 |
| SMILES | CN1N=CC=C1C=O |
| Synonym | 1-methyl-1h-pyrazole-5-carbaldehyde,2-methyl-2h-pyrazole-3-carbaldehyde,5-formyl-1-methyl-1h-pyrazole,1-methylpyrazole-5-carboxaldehyde,5-formyl-1-methylpyrazole,1-methylpyrazole-5-carbaldehyde,1h-pyrazole-5-carboxaldehyde, 1-methyl,1-methyl-1h-pyrazole-5-carboxaldehyde,pubchem16289,acmc-209gw7 |
| IUPAC Name | 2-methylpyrazole-3-carbaldehyde |
| InChI Key | RAJRANFZSWDUJZ-UHFFFAOYSA-N |
| Molecular Formula | C5H6N2O |
4'-Fluoro-2'-hydroxyacetophenone, 98%
CAS: 1481-27-2 Molecular Formula: C8H7FO2 Molecular Weight (g/mol): 154.14 MDL Number: MFCD00143203 InChI Key: HLTBTUXAMVOKIH-UHFFFAOYSA-N Synonym: 4'-fluoro-2'-hydroxyacetophenone,1-4-fluoro-2-hydroxyphenyl ethanone,4-fluoro-2-hydroxyacetophenone,1-4-fluoro-2-hydroxyphenyl ethan-1-one,ethanone, 1-4-fluoro-2-hydroxyphenyl,1-4-fluoro-2-hydroxy-phenyl ethanone,1-acetyl-4-fluoro-2-hydroxybenzene,pubchem13252,acmc-1bzss,4'-fluoro-2'-hydroxy PubChem CID: 2737326 IUPAC Name: 1-(4-fluoro-2-hydroxyphenyl)ethanone SMILES: CC(=O)C1=CC=C(F)C=C1O
| PubChem CID | 2737326 |
|---|---|
| CAS | 1481-27-2 |
| Molecular Weight (g/mol) | 154.14 |
| MDL Number | MFCD00143203 |
| SMILES | CC(=O)C1=CC=C(F)C=C1O |
| Synonym | 4'-fluoro-2'-hydroxyacetophenone,1-4-fluoro-2-hydroxyphenyl ethanone,4-fluoro-2-hydroxyacetophenone,1-4-fluoro-2-hydroxyphenyl ethan-1-one,ethanone, 1-4-fluoro-2-hydroxyphenyl,1-4-fluoro-2-hydroxy-phenyl ethanone,1-acetyl-4-fluoro-2-hydroxybenzene,pubchem13252,acmc-1bzss,4'-fluoro-2'-hydroxy |
| IUPAC Name | 1-(4-fluoro-2-hydroxyphenyl)ethanone |
| InChI Key | HLTBTUXAMVOKIH-UHFFFAOYSA-N |
| Molecular Formula | C8H7FO2 |
Ethyl 4-nitrobenzoylacetate, 97%
CAS: 838-57-3 Molecular Formula: C11H11NO5 Molecular Weight (g/mol): 237.211 MDL Number: MFCD00007357 InChI Key: NGRXSVFCLHVGKU-UHFFFAOYSA-N Synonym: ethyl 4-nitrobenzoylacetate,ethyl 3-4-nitrophenyl-3-oxopropanoate,ethyl p-nitrobenzoyl acetate,ethyl 4-nitrobenzoyl acetate,p-nitrobenzoyl acetic acid ethyl ester,ethyl p-nitrobenzoylacetate,4-nitrobenzoylacetic acid ethyl ester,ethyl 4-nitro-beta-oxobenzenepropanoate,4-nitrobenzoyl acetic acid ethyl ester,benzenepropanoic acid, 4-nitro-beta-oxo-, ethyl ester PubChem CID: 13281 IUPAC Name: ethyl 3-(4-nitrophenyl)-3-oxopropanoate SMILES: CCOC(=O)CC(=O)C1=CC=C(C=C1)[N+](=O)[O-]
| PubChem CID | 13281 |
|---|---|
| CAS | 838-57-3 |
| Molecular Weight (g/mol) | 237.211 |
| MDL Number | MFCD00007357 |
| SMILES | CCOC(=O)CC(=O)C1=CC=C(C=C1)[N+](=O)[O-] |
| Synonym | ethyl 4-nitrobenzoylacetate,ethyl 3-4-nitrophenyl-3-oxopropanoate,ethyl p-nitrobenzoyl acetate,ethyl 4-nitrobenzoyl acetate,p-nitrobenzoyl acetic acid ethyl ester,ethyl p-nitrobenzoylacetate,4-nitrobenzoylacetic acid ethyl ester,ethyl 4-nitro-beta-oxobenzenepropanoate,4-nitrobenzoyl acetic acid ethyl ester,benzenepropanoic acid, 4-nitro-beta-oxo-, ethyl ester |
| IUPAC Name | ethyl 3-(4-nitrophenyl)-3-oxopropanoate |
| InChI Key | NGRXSVFCLHVGKU-UHFFFAOYSA-N |
| Molecular Formula | C11H11NO5 |
Diethylene glycol mono-n-hexyl ether, 97%
CAS: 112-59-4 Molecular Formula: C10H22O3 Molecular Weight (g/mol): 190.28 MDL Number: MFCD00010703 InChI Key: GZMAAYIALGURDQ-UHFFFAOYSA-N Synonym: diethylene glycol monohexyl ether,2-2-hexyloxyethoxy ethanol,hexol carbitol,hexyl carbitol,n-hexyl carbitol,n-hexoxyethoxyethanol,3,6-dioxadodecanol-1,ethanol, 2-2-hexyloxy ethoxy,hexyldiglycol,hexylkarbitol PubChem CID: 8199 IUPAC Name: 2-(2-hexoxyethoxy)ethanol SMILES: CCCCCCOCCOCCO
| PubChem CID | 8199 |
|---|---|
| CAS | 112-59-4 |
| Molecular Weight (g/mol) | 190.28 |
| MDL Number | MFCD00010703 |
| SMILES | CCCCCCOCCOCCO |
| Synonym | diethylene glycol monohexyl ether,2-2-hexyloxyethoxy ethanol,hexol carbitol,hexyl carbitol,n-hexyl carbitol,n-hexoxyethoxyethanol,3,6-dioxadodecanol-1,ethanol, 2-2-hexyloxy ethoxy,hexyldiglycol,hexylkarbitol |
| IUPAC Name | 2-(2-hexoxyethoxy)ethanol |
| InChI Key | GZMAAYIALGURDQ-UHFFFAOYSA-N |
| Molecular Formula | C10H22O3 |
Methyl trifluoropyruvate, 97%
CAS: 13089-11-7 Molecular Formula: C4H3F3O3 Molecular Weight (g/mol): 156.06 MDL Number: MFCD00114936 InChI Key: XGLLQDIWQRQROJ-UHFFFAOYSA-N Synonym: methyl trifluoropyruvate,methyl 3,3,3-trifluoropyruvate,methyltrifluoropyruvate,trifluoropyruvic acid methyl ester,3,3,3-trifluoropyruvic acid methyl ester,propanoic acid, 3,3,3-trifluoro-2-oxo-, methyl ester,pubchem2012,rarechem al bf 1300,acmc-1bp0j PubChem CID: 2734931 IUPAC Name: methyl 3,3,3-trifluoro-2-oxopropanoate SMILES: COC(=O)C(=O)C(F)(F)F
| PubChem CID | 2734931 |
|---|---|
| CAS | 13089-11-7 |
| Molecular Weight (g/mol) | 156.06 |
| MDL Number | MFCD00114936 |
| SMILES | COC(=O)C(=O)C(F)(F)F |
| Synonym | methyl trifluoropyruvate,methyl 3,3,3-trifluoropyruvate,methyltrifluoropyruvate,trifluoropyruvic acid methyl ester,3,3,3-trifluoropyruvic acid methyl ester,propanoic acid, 3,3,3-trifluoro-2-oxo-, methyl ester,pubchem2012,rarechem al bf 1300,acmc-1bp0j |
| IUPAC Name | methyl 3,3,3-trifluoro-2-oxopropanoate |
| InChI Key | XGLLQDIWQRQROJ-UHFFFAOYSA-N |
| Molecular Formula | C4H3F3O3 |
3-Phenyl-1-propanol, 98%
CAS: 122-97-4 Molecular Formula: C9H12O Molecular Weight (g/mol): 136.19 MDL Number: MFCD00002950 InChI Key: VAJVDSVGBWFCLW-UHFFFAOYSA-N Synonym: 3-phenyl-1-propanol,benzenepropanol,hydrocinnamyl alcohol,3-phenylpropyl alcohol,3-phenylpropanol,3-benzenepropanol,phenylpropyl alcohol,hydrocinnamic alcohol,3-phenyl-n-propanol,3-hydroxypropyl benzene PubChem CID: 31234 IUPAC Name: 3-phenylpropan-1-ol SMILES: C1=CC=C(C=C1)CCCO
| PubChem CID | 31234 |
|---|---|
| CAS | 122-97-4 |
| Molecular Weight (g/mol) | 136.19 |
| MDL Number | MFCD00002950 |
| SMILES | C1=CC=C(C=C1)CCCO |
| Synonym | 3-phenyl-1-propanol,benzenepropanol,hydrocinnamyl alcohol,3-phenylpropyl alcohol,3-phenylpropanol,3-benzenepropanol,phenylpropyl alcohol,hydrocinnamic alcohol,3-phenyl-n-propanol,3-hydroxypropyl benzene |
| IUPAC Name | 3-phenylpropan-1-ol |
| InChI Key | VAJVDSVGBWFCLW-UHFFFAOYSA-N |
| Molecular Formula | C9H12O |