Organooxygen compounds
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1-Methoxynaphthalene, 98+%
CAS: 2216-69-5 Molecular Formula: C11H10O Molecular Weight (g/mol): 158.2 MDL Number: MFCD00003924 InChI Key: NQMUGNMMFTYOHK-UHFFFAOYSA-N Synonym: naphthalene, 1-methoxy,methyl 1-naphthyl ether,1-methoxy naphthalene,naphthalene, methoxy,alpha-methoxynaphthalene,unii-dg2eol57lf,.alpha.-methoxynaphthalene,methoxynaphthalene,alpha-naphthyl methyl ether,dg2eol57lf PubChem CID: 16668 IUPAC Name: 1-methoxynaphthalene SMILES: COC1=CC=CC2=CC=CC=C21
| PubChem CID | 16668 |
|---|---|
| CAS | 2216-69-5 |
| Molecular Weight (g/mol) | 158.2 |
| MDL Number | MFCD00003924 |
| SMILES | COC1=CC=CC2=CC=CC=C21 |
| Synonym | naphthalene, 1-methoxy,methyl 1-naphthyl ether,1-methoxy naphthalene,naphthalene, methoxy,alpha-methoxynaphthalene,unii-dg2eol57lf,.alpha.-methoxynaphthalene,methoxynaphthalene,alpha-naphthyl methyl ether,dg2eol57lf |
| IUPAC Name | 1-methoxynaphthalene |
| InChI Key | NQMUGNMMFTYOHK-UHFFFAOYSA-N |
| Molecular Formula | C11H10O |
cis-Epoxysuccinic acid, 97%
CAS: 16533-72-5 Molecular Formula: C4H4O5 Molecular Weight (g/mol): 132.07 MDL Number: MFCD00191645 InChI Key: DCEMCPAKSGRHCN-XIXRPRMCSA-N Synonym: cis-epoxysuccinic acid,2r,3s-oxirane-2,3-dicarboxylic acid,cis-oxirane-2,3-dicarboxylic acid,2,3-oxiranedicarboxylic acid, 2r,3s-rel,2,3-oxiranedicarboxylic acid, 2r,3s-rel-9ci PubChem CID: 2734802 IUPAC Name: (2S,3R)-oxirane-2,3-dicarboxylic acid SMILES: C1(C(O1)C(=O)O)C(=O)O
| PubChem CID | 2734802 |
|---|---|
| CAS | 16533-72-5 |
| Molecular Weight (g/mol) | 132.07 |
| MDL Number | MFCD00191645 |
| SMILES | C1(C(O1)C(=O)O)C(=O)O |
| Synonym | cis-epoxysuccinic acid,2r,3s-oxirane-2,3-dicarboxylic acid,cis-oxirane-2,3-dicarboxylic acid,2,3-oxiranedicarboxylic acid, 2r,3s-rel,2,3-oxiranedicarboxylic acid, 2r,3s-rel-9ci |
| IUPAC Name | (2S,3R)-oxirane-2,3-dicarboxylic acid |
| InChI Key | DCEMCPAKSGRHCN-XIXRPRMCSA-N |
| Molecular Formula | C4H4O5 |
(R)-4-(1-Hydroxyethyl)pyridine, 99+%, (99+% ee), Thermo Scientific™
CAS: 27854-88-2 Molecular Formula: C7H9NO Molecular Weight (g/mol): 123.15 MDL Number: MFCD00077865 InChI Key: HVOAMIOKNARIMR-ZCFIWIBFSA-N Synonym: r-1-pyridin-4-yl ethanol,r-+-1-4-pyridyl ethanol,1r-1-pyridin-4-yl ethan-1-ol,r-1-4-pyridyl ethanol,1r-1-pyridin-4-yl ethanol,r-4-1-hydroxyethyl pyridine,1r-1-pyridin-4-ylethanol,r-1-pyridin-4-yl-ethanol,1r-1-4-pyridyl ethanol PubChem CID: 11804747 IUPAC Name: (1R)-1-pyridin-4-ylethanol SMILES: CC(C1=CC=NC=C1)O
| PubChem CID | 11804747 |
|---|---|
| CAS | 27854-88-2 |
| Molecular Weight (g/mol) | 123.15 |
| MDL Number | MFCD00077865 |
| SMILES | CC(C1=CC=NC=C1)O |
| Synonym | r-1-pyridin-4-yl ethanol,r-+-1-4-pyridyl ethanol,1r-1-pyridin-4-yl ethan-1-ol,r-1-4-pyridyl ethanol,1r-1-pyridin-4-yl ethanol,r-4-1-hydroxyethyl pyridine,1r-1-pyridin-4-ylethanol,r-1-pyridin-4-yl-ethanol,1r-1-4-pyridyl ethanol |
| IUPAC Name | (1R)-1-pyridin-4-ylethanol |
| InChI Key | HVOAMIOKNARIMR-ZCFIWIBFSA-N |
| Molecular Formula | C7H9NO |
Ethyl 2-ethylacetoacetate, 95%
CAS: 607-97-6 Molecular Formula: C8H14O3 Molecular Weight (g/mol): 158.197 MDL Number: MFCD00039898 InChI Key: OKANYBNORCUPKZ-UHFFFAOYSA-N Synonym: ethyl 2-ethylacetoacetate,ethyl 2-acetylbutyrate,butanoic acid, 2-ethyl-3-oxo-, ethyl ester,2-ethylacetoacetic acid ethyl ester,ethyl 2-ethyl-3-ketobutyrate,ethyl alpha-ethylacetoacetate,ethyl-2-ethylacetoacetate,2-ethyl-3-oxo-butyric acid ethyl ester,ethyl .alpha.-acetylbutyrate,ethyl 2-ethyl-3-oxo-butanoate PubChem CID: 79065 IUPAC Name: ethyl 2-ethyl-3-oxobutanoate SMILES: CCC(C(=O)C)C(=O)OCC
| PubChem CID | 79065 |
|---|---|
| CAS | 607-97-6 |
| Molecular Weight (g/mol) | 158.197 |
| MDL Number | MFCD00039898 |
| SMILES | CCC(C(=O)C)C(=O)OCC |
| Synonym | ethyl 2-ethylacetoacetate,ethyl 2-acetylbutyrate,butanoic acid, 2-ethyl-3-oxo-, ethyl ester,2-ethylacetoacetic acid ethyl ester,ethyl 2-ethyl-3-ketobutyrate,ethyl alpha-ethylacetoacetate,ethyl-2-ethylacetoacetate,2-ethyl-3-oxo-butyric acid ethyl ester,ethyl .alpha.-acetylbutyrate,ethyl 2-ethyl-3-oxo-butanoate |
| IUPAC Name | ethyl 2-ethyl-3-oxobutanoate |
| InChI Key | OKANYBNORCUPKZ-UHFFFAOYSA-N |
| Molecular Formula | C8H14O3 |
3-Benzyloxybenzaldehyde, 98%
CAS: 1700-37-4 Molecular Formula: C14H12O2 Molecular Weight (g/mol): 212.248 MDL Number: MFCD00003367 InChI Key: JAICGBJIBWDEIZ-UHFFFAOYSA-N Synonym: 3-benzyloxybenzaldehyde,3-benzyloxy benzaldehyde,benzaldehyde, 3-phenylmethoxy,m-benzyloxybenzaldehyde,benzaldehyde, m-benzyloxy,3-phenylmethoxy benzaldehyde,3-benzyloxy-benzaldehyde,unii-k1s6ob2gnn,k1s6ob2gnn PubChem CID: 74342 IUPAC Name: 3-phenylmethoxybenzaldehyde SMILES: C1=CC=C(C=C1)COC2=CC=CC(=C2)C=O
| PubChem CID | 74342 |
|---|---|
| CAS | 1700-37-4 |
| Molecular Weight (g/mol) | 212.248 |
| MDL Number | MFCD00003367 |
| SMILES | C1=CC=C(C=C1)COC2=CC=CC(=C2)C=O |
| Synonym | 3-benzyloxybenzaldehyde,3-benzyloxy benzaldehyde,benzaldehyde, 3-phenylmethoxy,m-benzyloxybenzaldehyde,benzaldehyde, m-benzyloxy,3-phenylmethoxy benzaldehyde,3-benzyloxy-benzaldehyde,unii-k1s6ob2gnn,k1s6ob2gnn |
| IUPAC Name | 3-phenylmethoxybenzaldehyde |
| InChI Key | JAICGBJIBWDEIZ-UHFFFAOYSA-N |
| Molecular Formula | C14H12O2 |
Ethoxyacetic acid, 98%
CAS: 627-03-2 Molecular Formula: C4H8O3 Molecular Weight (g/mol): 104.105 MDL Number: MFCD00004310 InChI Key: YZGQDNOIGFBYKF-UHFFFAOYSA-N Synonym: ethoxyacetic acid,acetic acid, ethoxy,ethoxy acetic acid,acetic acid, 2-ethoxy,ethoxy-acetic acid,unii-467vw095bx,o-ethylglycolic acid,ccris 7194,2-ethoxy-acetic acid,dsstox_cid_11294 PubChem CID: 12301 IUPAC Name: 2-ethoxyacetic acid SMILES: CCOCC(=O)O
| PubChem CID | 12301 |
|---|---|
| CAS | 627-03-2 |
| Molecular Weight (g/mol) | 104.105 |
| MDL Number | MFCD00004310 |
| SMILES | CCOCC(=O)O |
| Synonym | ethoxyacetic acid,acetic acid, ethoxy,ethoxy acetic acid,acetic acid, 2-ethoxy,ethoxy-acetic acid,unii-467vw095bx,o-ethylglycolic acid,ccris 7194,2-ethoxy-acetic acid,dsstox_cid_11294 |
| IUPAC Name | 2-ethoxyacetic acid |
| InChI Key | YZGQDNOIGFBYKF-UHFFFAOYSA-N |
| Molecular Formula | C4H8O3 |
4,4'-Dichlorobutyrophenone, 97%
CAS: 40877-09-6 Molecular Formula: C10H10Cl2O Molecular Weight (g/mol): 217.089 MDL Number: MFCD00018993 InChI Key: UKCHLVFIVJBCKE-UHFFFAOYSA-N Synonym: 4-chloro-1-4-chlorophenyl butan-1-one,4,4'-dichlorobutyrophenone,1-butanone, 4-chloro-1-4-chlorophenyl,gamma,p-dichlorobutyrophenone,4-chloro-1-4-chlorophenyl-1-oxobutane,4-chloro-1-4-chlorophenyl-1-butanone,acmc-20a5su,4',gamma-dichlorobutyrophenone,4-chloro-4'-chlorobutyrophenone,4-chloro-4'-chloro-butyrophenone PubChem CID: 2723781 IUPAC Name: 4-chloro-1-(4-chlorophenyl)butan-1-one SMILES: C1=CC(=CC=C1C(=O)CCCCl)Cl
| PubChem CID | 2723781 |
|---|---|
| CAS | 40877-09-6 |
| Molecular Weight (g/mol) | 217.089 |
| MDL Number | MFCD00018993 |
| SMILES | C1=CC(=CC=C1C(=O)CCCCl)Cl |
| Synonym | 4-chloro-1-4-chlorophenyl butan-1-one,4,4'-dichlorobutyrophenone,1-butanone, 4-chloro-1-4-chlorophenyl,gamma,p-dichlorobutyrophenone,4-chloro-1-4-chlorophenyl-1-oxobutane,4-chloro-1-4-chlorophenyl-1-butanone,acmc-20a5su,4',gamma-dichlorobutyrophenone,4-chloro-4'-chlorobutyrophenone,4-chloro-4'-chloro-butyrophenone |
| IUPAC Name | 4-chloro-1-(4-chlorophenyl)butan-1-one |
| InChI Key | UKCHLVFIVJBCKE-UHFFFAOYSA-N |
| Molecular Formula | C10H10Cl2O |
Indole-5-carboxaldehyde, 98+%
CAS: 1196-69-6 Molecular Formula: C9H7NO Molecular Weight (g/mol): 145.16 MDL Number: MFCD02093664 InChI Key: ADZUEEUKBYCSEY-UHFFFAOYSA-N Synonym: indole-5-carboxaldehyde,5-formylindole,indole-5-carbaldehyde,1h-indole-5-carboxaldehyde,5-indolealdehyde,indole-5-aldehyde,5-formyl-1h-indole,5-indolecarboxaldehyde,indole-5-carboxaldehyde 5-formylindole,5-formyl-indole PubChem CID: 589040 IUPAC Name: 1H-indole-5-carbaldehyde SMILES: C1=CC2=C(C=CN2)C=C1C=O
| PubChem CID | 589040 |
|---|---|
| CAS | 1196-69-6 |
| Molecular Weight (g/mol) | 145.16 |
| MDL Number | MFCD02093664 |
| SMILES | C1=CC2=C(C=CN2)C=C1C=O |
| Synonym | indole-5-carboxaldehyde,5-formylindole,indole-5-carbaldehyde,1h-indole-5-carboxaldehyde,5-indolealdehyde,indole-5-aldehyde,5-formyl-1h-indole,5-indolecarboxaldehyde,indole-5-carboxaldehyde 5-formylindole,5-formyl-indole |
| IUPAC Name | 1H-indole-5-carbaldehyde |
| InChI Key | ADZUEEUKBYCSEY-UHFFFAOYSA-N |
| Molecular Formula | C9H7NO |
3'-Benzyloxyacetophenone, 97%
CAS: 34068-01-4 Molecular Formula: C15H14O2 Molecular Weight (g/mol): 226.275 MDL Number: MFCD00026221 InChI Key: FGQMEAWGAUALJQ-UHFFFAOYSA-N Synonym: 1-3-benzyloxy phenyl ethanone,3-benzyloxyacetophenone,3'-benzyloxyacetophenone,1-3-benzyloxy phenyl ethan-1-one,1-3-phenylmethoxy phenyl ethan-1-one,3'-benzyloxy acetophenone,ethanone, 1-3-phenylmethoxy phenyl,1-acetyl-3-phenylmethoxy benzene PubChem CID: 98689 IUPAC Name: 1-(3-phenylmethoxyphenyl)ethanone SMILES: CC(=O)C1=CC(=CC=C1)OCC2=CC=CC=C2
| PubChem CID | 98689 |
|---|---|
| CAS | 34068-01-4 |
| Molecular Weight (g/mol) | 226.275 |
| MDL Number | MFCD00026221 |
| SMILES | CC(=O)C1=CC(=CC=C1)OCC2=CC=CC=C2 |
| Synonym | 1-3-benzyloxy phenyl ethanone,3-benzyloxyacetophenone,3'-benzyloxyacetophenone,1-3-benzyloxy phenyl ethan-1-one,1-3-phenylmethoxy phenyl ethan-1-one,3'-benzyloxy acetophenone,ethanone, 1-3-phenylmethoxy phenyl,1-acetyl-3-phenylmethoxy benzene |
| IUPAC Name | 1-(3-phenylmethoxyphenyl)ethanone |
| InChI Key | FGQMEAWGAUALJQ-UHFFFAOYSA-N |
| Molecular Formula | C15H14O2 |
Methyl malonamate, 98%
CAS: 51513-29-2 Molecular Formula: C4H7NO3 Molecular Weight (g/mol): 117.10 MDL Number: MFCD00674533 InChI Key: LSNSJCKGQREPDW-UHFFFAOYSA-N Synonym: methyl malonamate,methyl malonate monoamide,methyl 2-carbamoylacetate,propanoic acid, 3-amino-3-oxo-, methyl ester,acmc-20akfl,methyl carbamoylacetate,methyl-malonate monoamide,malonamic acid methyl ester,malonamidic acid methyl ester,methyl 3-amino-3-oxo-propanoate PubChem CID: 3595299 IUPAC Name: methyl 3-amino-3-oxopropanoate SMILES: COC(=O)CC(N)=O
| PubChem CID | 3595299 |
|---|---|
| CAS | 51513-29-2 |
| Molecular Weight (g/mol) | 117.10 |
| MDL Number | MFCD00674533 |
| SMILES | COC(=O)CC(N)=O |
| Synonym | methyl malonamate,methyl malonate monoamide,methyl 2-carbamoylacetate,propanoic acid, 3-amino-3-oxo-, methyl ester,acmc-20akfl,methyl carbamoylacetate,methyl-malonate monoamide,malonamic acid methyl ester,malonamidic acid methyl ester,methyl 3-amino-3-oxo-propanoate |
| IUPAC Name | methyl 3-amino-3-oxopropanoate |
| InChI Key | LSNSJCKGQREPDW-UHFFFAOYSA-N |
| Molecular Formula | C4H7NO3 |
Diethyl (2,4-dichlorophenyl)malonate, 95%
CAS: 111544-93-5 Molecular Formula: C13H14Cl2O4 Molecular Weight (g/mol): 305.15 MDL Number: MFCD00831103 InChI Key: FIGCCTUCURBNIF-UHFFFAOYSA-N Synonym: diethyl 2-2,4-dichlorophenyl malonate,diethyl 2,4-dichlorophenyl malonate,1,3-diethyl 2-2,4-dichlorophenyl propanedioate,diethyl 2-2,4-dichlorophenyl propanedioate,diethyl 2,4-dichlorophenyl propanedioate,diethyl 2,4-dichlorophenylmalonate,2-2,4-dichloro-phenyl-malonic acid diethyl ester,propanedioic acid,2-2,4-dichlorophenyl-,1,3-diethyl ester PubChem CID: 2736112 IUPAC Name: diethyl 2-(2,4-dichlorophenyl)propanedioate SMILES: CCOC(=O)C(C(=O)OCC)C1=CC=C(Cl)C=C1Cl
| PubChem CID | 2736112 |
|---|---|
| CAS | 111544-93-5 |
| Molecular Weight (g/mol) | 305.15 |
| MDL Number | MFCD00831103 |
| SMILES | CCOC(=O)C(C(=O)OCC)C1=CC=C(Cl)C=C1Cl |
| Synonym | diethyl 2-2,4-dichlorophenyl malonate,diethyl 2,4-dichlorophenyl malonate,1,3-diethyl 2-2,4-dichlorophenyl propanedioate,diethyl 2-2,4-dichlorophenyl propanedioate,diethyl 2,4-dichlorophenyl propanedioate,diethyl 2,4-dichlorophenylmalonate,2-2,4-dichloro-phenyl-malonic acid diethyl ester,propanedioic acid,2-2,4-dichlorophenyl-,1,3-diethyl ester |
| IUPAC Name | diethyl 2-(2,4-dichlorophenyl)propanedioate |
| InChI Key | FIGCCTUCURBNIF-UHFFFAOYSA-N |
| Molecular Formula | C13H14Cl2O4 |
trans-2-Nonenal, 95%, Thermo Scientific™
CAS: 18829-56-6 Molecular Formula: C9H16O Molecular Weight (g/mol): 140.23 MDL Number: MFCD00007012 InChI Key: BSAIUMLZVGUGKX-BQYQJAHWSA-N Synonym: trans-2-nonenal,2-nonenal,e-2-nonenal,e-non-2-enal,3-hexylacrolein,2-nonenal, 2e,beta-hexylacrolein,2-nonenal, e,heptylideneacetaldehyde,alpha-nonenyl aldehyde PubChem CID: 5283335 IUPAC Name: (E)-non-2-enal SMILES: CCCCCCC=CC=O
| PubChem CID | 5283335 |
|---|---|
| CAS | 18829-56-6 |
| Molecular Weight (g/mol) | 140.23 |
| MDL Number | MFCD00007012 |
| SMILES | CCCCCCC=CC=O |
| Synonym | trans-2-nonenal,2-nonenal,e-2-nonenal,e-non-2-enal,3-hexylacrolein,2-nonenal, 2e,beta-hexylacrolein,2-nonenal, e,heptylideneacetaldehyde,alpha-nonenyl aldehyde |
| IUPAC Name | (E)-non-2-enal |
| InChI Key | BSAIUMLZVGUGKX-BQYQJAHWSA-N |
| Molecular Formula | C9H16O |
7-Methoxyindole, 97%, Thermo Scientific™
CAS: 3189-22-8 Molecular Formula: C9H9NO Molecular Weight (g/mol): 147.18 MDL Number: MFCD00047203 InChI Key: FSOPPXYMWZOKRM-UHFFFAOYSA-N Synonym: 7-methoxyindole,7-methoxy indole,1h-indole, 7-methoxy,indole, 7-methoxy,methoxyindole 7-,unii-9r05qk9rp4,7-methoxy-indole,pubchem7434,acmc-209hpi PubChem CID: 76660 IUPAC Name: 7-methoxy-1H-indole SMILES: COC1=CC=CC2=C1NC=C2
| PubChem CID | 76660 |
|---|---|
| CAS | 3189-22-8 |
| Molecular Weight (g/mol) | 147.18 |
| MDL Number | MFCD00047203 |
| SMILES | COC1=CC=CC2=C1NC=C2 |
| Synonym | 7-methoxyindole,7-methoxy indole,1h-indole, 7-methoxy,indole, 7-methoxy,methoxyindole 7-,unii-9r05qk9rp4,7-methoxy-indole,pubchem7434,acmc-209hpi |
| IUPAC Name | 7-methoxy-1H-indole |
| InChI Key | FSOPPXYMWZOKRM-UHFFFAOYSA-N |
| Molecular Formula | C9H9NO |
Acetaldehyde ethyl propargyl acetal, 98%, Thermo Scientific™
CAS: 18669-04-0 Molecular Formula: C7H12O2 Molecular Weight (g/mol): 128.17 MDL Number: MFCD00066344 InChI Key: QKBBTQJLUGADEG-UHFFFAOYSA-N PubChem CID: 86774 IUPAC Name: 3-(1-ethoxyethoxy)prop-1-yne SMILES: CCOC(C)OCC#C
| PubChem CID | 86774 |
|---|---|
| CAS | 18669-04-0 |
| Molecular Weight (g/mol) | 128.17 |
| MDL Number | MFCD00066344 |
| SMILES | CCOC(C)OCC#C |
| IUPAC Name | 3-(1-ethoxyethoxy)prop-1-yne |
| InChI Key | QKBBTQJLUGADEG-UHFFFAOYSA-N |
| Molecular Formula | C7H12O2 |
Oleyl alcohol, 99+%
CAS: 143-28-2 Molecular Formula: C18H36O Molecular Weight (g/mol): 268.49 MDL Number: MFCD00002993 InChI Key: ALSTYHKOOCGGFT-KTKRTIGZSA-N Synonym: oleyl alcohol,cis-9-octadecen-1-ol,z-octadec-9-en-1-ol,ocenol,conditioner 1,dermaffine,lancol,novol,oceol,oleol PubChem CID: 5284499 ChEBI: CHEBI:73504 IUPAC Name: (Z)-octadec-9-en-1-ol SMILES: CCCCCCCC\C=C/CCCCCCCCO
| PubChem CID | 5284499 |
|---|---|
| CAS | 143-28-2 |
| Molecular Weight (g/mol) | 268.49 |
| ChEBI | CHEBI:73504 |
| MDL Number | MFCD00002993 |
| SMILES | CCCCCCCC\C=C/CCCCCCCCO |
| Synonym | oleyl alcohol,cis-9-octadecen-1-ol,z-octadec-9-en-1-ol,ocenol,conditioner 1,dermaffine,lancol,novol,oceol,oleol |
| IUPAC Name | (Z)-octadec-9-en-1-ol |
| InChI Key | ALSTYHKOOCGGFT-KTKRTIGZSA-N |
| Molecular Formula | C18H36O |