Organooxygen compounds
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2-Methoxyethoxymethyl Chloride 95.0+%, TCI America™
CAS: 3970-21-6 Molecular Formula: C4H9ClO2 Molecular Weight (g/mol): 124.56 MDL Number: MFCD00000888 InChI Key: BIAAQBNMRITRDV-UHFFFAOYSA-N Synonym: 2-methoxyethoxymethyl chloride,1-chloromethoxy-2-methoxyethane,ethane, 1-chloromethoxy-2-methoxy,mem chloride,methoxyethoxymethyl chloride,mem-chloride,1-chloro-2,5-dioxahexane,2-methoxyethoxy methyl chloride,beta-methoxyethoxymethyl chloride,.beta.-methoxyethoxymethyl chloride PubChem CID: 77590 IUPAC Name: 1-(chloromethoxy)-2-methoxyethane SMILES: COCCOCCl
| PubChem CID | 77590 |
|---|---|
| CAS | 3970-21-6 |
| Molecular Weight (g/mol) | 124.56 |
| MDL Number | MFCD00000888 |
| SMILES | COCCOCCl |
| Synonym | 2-methoxyethoxymethyl chloride,1-chloromethoxy-2-methoxyethane,ethane, 1-chloromethoxy-2-methoxy,mem chloride,methoxyethoxymethyl chloride,mem-chloride,1-chloro-2,5-dioxahexane,2-methoxyethoxy methyl chloride,beta-methoxyethoxymethyl chloride,.beta.-methoxyethoxymethyl chloride |
| IUPAC Name | 1-(chloromethoxy)-2-methoxyethane |
| InChI Key | BIAAQBNMRITRDV-UHFFFAOYSA-N |
| Molecular Formula | C4H9ClO2 |
5-Methoxyindole 99.0+%, TCI America™
CAS: 1006-94-6 Molecular Formula: C9H9NO Molecular Weight (g/mol): 147.177 MDL Number: MFCD00005674 InChI Key: DWAQDRSOVMLGRQ-UHFFFAOYSA-N Synonym: 5-methoxyindole,1h-indole, 5-methoxy,femedol,5-methoxy indole,indol-5-yl methyl ether,indole, 5-methoxy,methoxy-5 indole,unii-dqm3as43pq,methoxy-5 indole french,methoxyindole 5- PubChem CID: 13872 IUPAC Name: 5-methoxy-1H-indole SMILES: COC1=CC2=C(C=C1)NC=C2
| PubChem CID | 13872 |
|---|---|
| CAS | 1006-94-6 |
| Molecular Weight (g/mol) | 147.177 |
| MDL Number | MFCD00005674 |
| SMILES | COC1=CC2=C(C=C1)NC=C2 |
| Synonym | 5-methoxyindole,1h-indole, 5-methoxy,femedol,5-methoxy indole,indol-5-yl methyl ether,indole, 5-methoxy,methoxy-5 indole,unii-dqm3as43pq,methoxy-5 indole french,methoxyindole 5- |
| IUPAC Name | 5-methoxy-1H-indole |
| InChI Key | DWAQDRSOVMLGRQ-UHFFFAOYSA-N |
| Molecular Formula | C9H9NO |
Methylmalonic Acid 98.0+%, TCI America™
CAS: 516-05-2 Molecular Formula: C4H6O4 Molecular Weight (g/mol): 118.09 MDL Number: MFCD00002656 InChI Key: ZIYVHBGGAOATLY-UHFFFAOYSA-N Synonym: methylmalonic acid,2-methylmalonic acid,isosuccinic acid,methylmalonate,propanedioic acid, methyl,1,1-ethanedicarboxylic acid,malonic acid, methyl,methyl malonic acid,methylpropanedioic acid,unii-8ll8s712j7 PubChem CID: 487 ChEBI: CHEBI:30860 IUPAC Name: 2-methylpropanedioic acid SMILES: CC(C(O)=O)C(O)=O
| PubChem CID | 487 |
|---|---|
| CAS | 516-05-2 |
| Molecular Weight (g/mol) | 118.09 |
| ChEBI | CHEBI:30860 |
| MDL Number | MFCD00002656 |
| SMILES | CC(C(O)=O)C(O)=O |
| Synonym | methylmalonic acid,2-methylmalonic acid,isosuccinic acid,methylmalonate,propanedioic acid, methyl,1,1-ethanedicarboxylic acid,malonic acid, methyl,methyl malonic acid,methylpropanedioic acid,unii-8ll8s712j7 |
| IUPAC Name | 2-methylpropanedioic acid |
| InChI Key | ZIYVHBGGAOATLY-UHFFFAOYSA-N |
| Molecular Formula | C4H6O4 |
4-Methyl-2-oxovaleric Acid 95.0+%, TCI America™
CAS: 816-66-0 Molecular Formula: C6H9NaO3 Molecular Weight (g/mol): 152.13 MDL Number: MFCD00066204 InChI Key: IXFAZKRLPPMQEO-UHFFFAOYSA-M Synonym: 4-methyl-2-oxovaleric acid,alpha-ketoisocaproic acid,ketoleucine,alpha-ketoisocaproate,pentanoic acid, 4-methyl-2-oxo,2-oxoisocaproate,2-oxo-4-methylpentanoic acid,ketoisocaproate,2-oxoisohexanoate,4-methyl-2-oxopentanoate PubChem CID: 70 ChEBI: CHEBI:48430 IUPAC Name: sodium 4-methyl-2-oxopentanoate SMILES: [Na+].CC(C)CC(=O)C([O-])=O
| PubChem CID | 70 |
|---|---|
| CAS | 816-66-0 |
| Molecular Weight (g/mol) | 152.13 |
| ChEBI | CHEBI:48430 |
| MDL Number | MFCD00066204 |
| SMILES | [Na+].CC(C)CC(=O)C([O-])=O |
| Synonym | 4-methyl-2-oxovaleric acid,alpha-ketoisocaproic acid,ketoleucine,alpha-ketoisocaproate,pentanoic acid, 4-methyl-2-oxo,2-oxoisocaproate,2-oxo-4-methylpentanoic acid,ketoisocaproate,2-oxoisohexanoate,4-methyl-2-oxopentanoate |
| IUPAC Name | sodium 4-methyl-2-oxopentanoate |
| InChI Key | IXFAZKRLPPMQEO-UHFFFAOYSA-M |
| Molecular Formula | C6H9NaO3 |
Ethyl Glycolate 98.0+%, TCI America™
CAS: 623-50-7 Molecular Formula: C4H8O3 Molecular Weight (g/mol): 104.11 MDL Number: MFCD00021970 InChI Key: ZANNOFHADGWOLI-UHFFFAOYSA-N Synonym: ethyl glycolate,ethyl hydroxyacetate,acetic acid, hydroxy-, ethyl ester,glycolic acid, ethyl ester,ethyl glycollate,hydroxyacetic acid ethyl ester,glycolic acid ethyl ester,unii-c306e91wfk,acetic acid, 2-hydroxy-, ethyl ester,2-hydroxyacetic acid ethyl ester PubChem CID: 12184 IUPAC Name: ethyl 2-hydroxyacetate SMILES: CCOC(=O)CO
| PubChem CID | 12184 |
|---|---|
| CAS | 623-50-7 |
| Molecular Weight (g/mol) | 104.11 |
| MDL Number | MFCD00021970 |
| SMILES | CCOC(=O)CO |
| Synonym | ethyl glycolate,ethyl hydroxyacetate,acetic acid, hydroxy-, ethyl ester,glycolic acid, ethyl ester,ethyl glycollate,hydroxyacetic acid ethyl ester,glycolic acid ethyl ester,unii-c306e91wfk,acetic acid, 2-hydroxy-, ethyl ester,2-hydroxyacetic acid ethyl ester |
| IUPAC Name | ethyl 2-hydroxyacetate |
| InChI Key | ZANNOFHADGWOLI-UHFFFAOYSA-N |
| Molecular Formula | C4H8O3 |
Ethyl Glyoxylate Polymer form (47% in Toluene), TCI America™
CAS: 924-44-7 Molecular Formula: C4H6O3 Molecular Weight (g/mol): 102.089 MDL Number: MFCD00044009 InChI Key: DBPFRRFGLYGEJI-UHFFFAOYSA-N Synonym: ethyl glyoxalate,ethyl glyoxylate,ethyl oxoacetate,glyoxylic acid ethyl ester,acetic acid, oxo-, ethyl ester,ethyl glyoxalate solution,unii-ixx9mq1j1i,acetic acid, 2-oxo-, ethyl ester,ixx9mq1j1i,2-oxoacetic acid, ethyl ester PubChem CID: 70211 ChEBI: CHEBI:53275 IUPAC Name: ethyl 2-oxoacetate SMILES: CCOC(=O)C=O
| PubChem CID | 70211 |
|---|---|
| CAS | 924-44-7 |
| Molecular Weight (g/mol) | 102.089 |
| ChEBI | CHEBI:53275 |
| MDL Number | MFCD00044009 |
| SMILES | CCOC(=O)C=O |
| Synonym | ethyl glyoxalate,ethyl glyoxylate,ethyl oxoacetate,glyoxylic acid ethyl ester,acetic acid, oxo-, ethyl ester,ethyl glyoxalate solution,unii-ixx9mq1j1i,acetic acid, 2-oxo-, ethyl ester,ixx9mq1j1i,2-oxoacetic acid, ethyl ester |
| IUPAC Name | ethyl 2-oxoacetate |
| InChI Key | DBPFRRFGLYGEJI-UHFFFAOYSA-N |
| Molecular Formula | C4H6O3 |
Heptanal 95.0+%, TCI America™
CAS: 111-71-7 Molecular Formula: C7H14O Molecular Weight (g/mol): 114.19 MDL Number: MFCD00007028 InChI Key: FXHGMKSSBGDXIY-UHFFFAOYSA-N Synonym: heptaldehyde,enanthaldehyde,n-heptaldehyde,enanthal,heptyl aldehyde,heptanaldehyde,n-heptanal,oenanthaldehyde,enanthole,oenanthal PubChem CID: 8130 ChEBI: CHEBI:34787 IUPAC Name: heptanal SMILES: CCCCCCC=O
| PubChem CID | 8130 |
|---|---|
| CAS | 111-71-7 |
| Molecular Weight (g/mol) | 114.19 |
| ChEBI | CHEBI:34787 |
| MDL Number | MFCD00007028 |
| SMILES | CCCCCCC=O |
| Synonym | heptaldehyde,enanthaldehyde,n-heptaldehyde,enanthal,heptyl aldehyde,heptanaldehyde,n-heptanal,oenanthaldehyde,enanthole,oenanthal |
| IUPAC Name | heptanal |
| InChI Key | FXHGMKSSBGDXIY-UHFFFAOYSA-N |
| Molecular Formula | C7H14O |
4-Hydroxybenzaldehyde 98.0+%, TCI America™
CAS: 123-08-0 Molecular Formula: C7H6O2 Molecular Weight (g/mol): 122.123 MDL Number: MFCD00006939 InChI Key: RGHHSNMVTDWUBI-UHFFFAOYSA-N Synonym: p-hydroxybenzaldehyde,4-formylphenol,p-formylphenol,p-oxybenzaldehyde,benzaldehyde, 4-hydroxy,parahydroxybenzaldehyde,benzaldehyde, p-hydroxy,4-hydroxy-benzaldehyde,usaf m-6,4-hydroxy benzaldehyde PubChem CID: 126 ChEBI: CHEBI:17597 IUPAC Name: 4-hydroxybenzaldehyde SMILES: C1=CC(=CC=C1C=O)O
| PubChem CID | 126 |
|---|---|
| CAS | 123-08-0 |
| Molecular Weight (g/mol) | 122.123 |
| ChEBI | CHEBI:17597 |
| MDL Number | MFCD00006939 |
| SMILES | C1=CC(=CC=C1C=O)O |
| Synonym | p-hydroxybenzaldehyde,4-formylphenol,p-formylphenol,p-oxybenzaldehyde,benzaldehyde, 4-hydroxy,parahydroxybenzaldehyde,benzaldehyde, p-hydroxy,4-hydroxy-benzaldehyde,usaf m-6,4-hydroxy benzaldehyde |
| IUPAC Name | 4-hydroxybenzaldehyde |
| InChI Key | RGHHSNMVTDWUBI-UHFFFAOYSA-N |
| Molecular Formula | C7H6O2 |
1,2-Hexadecanediol 98.0+%, TCI America™
CAS: 6920-24-7 Molecular Formula: C16H34O2 Molecular Weight (g/mol): 258.45 MDL Number: MFCD00004727 InChI Key: BTOOAFQCTJZDRC-UHFFFAOYNA-N Synonym: 1,2-Dihydroxyhexadecane PubChem CID: 98037 ChEBI: CHEBI:75586 IUPAC Name: hexadecane-1,2-diol SMILES: CCCCCCCCCCCCCCC(O)CO
| PubChem CID | 98037 |
|---|---|
| CAS | 6920-24-7 |
| Molecular Weight (g/mol) | 258.45 |
| ChEBI | CHEBI:75586 |
| MDL Number | MFCD00004727 |
| SMILES | CCCCCCCCCCCCCCC(O)CO |
| Synonym | 1,2-Dihydroxyhexadecane |
| IUPAC Name | hexadecane-1,2-diol |
| InChI Key | BTOOAFQCTJZDRC-UHFFFAOYNA-N |
| Molecular Formula | C16H34O2 |
2'-Hydroxy-5'-methylacetophenone 98.0+%, TCI America™
CAS: 1450-72-2 Molecular Formula: C9H10O2 Molecular Weight (g/mol): 150.177 MDL Number: MFCD00002380 InChI Key: YNPDFBFVMJNGKZ-UHFFFAOYSA-N Synonym: 2'-hydroxy-5'-methylacetophenone,1-2-hydroxy-5-methylphenyl ethanone,2-hydroxy-5-methylacetophenone,o-acetyl-p-cresol,ethanone, 1-2-hydroxy-5-methylphenyl,2-acetyl-4-methylphenol,1-2-hydroxy-5-methylphenyl ethan-1-one,1-hydroxy-2-acetyl-4-methylbenzene,1-2-hydroxy-5-methyl-phenyl-ethanone,unii-11661u1zen PubChem CID: 15068 IUPAC Name: 1-(2-hydroxy-5-methylphenyl)ethanone SMILES: CC1=CC(=C(C=C1)O)C(=O)C
| PubChem CID | 15068 |
|---|---|
| CAS | 1450-72-2 |
| Molecular Weight (g/mol) | 150.177 |
| MDL Number | MFCD00002380 |
| SMILES | CC1=CC(=C(C=C1)O)C(=O)C |
| Synonym | 2'-hydroxy-5'-methylacetophenone,1-2-hydroxy-5-methylphenyl ethanone,2-hydroxy-5-methylacetophenone,o-acetyl-p-cresol,ethanone, 1-2-hydroxy-5-methylphenyl,2-acetyl-4-methylphenol,1-2-hydroxy-5-methylphenyl ethan-1-one,1-hydroxy-2-acetyl-4-methylbenzene,1-2-hydroxy-5-methyl-phenyl-ethanone,unii-11661u1zen |
| IUPAC Name | 1-(2-hydroxy-5-methylphenyl)ethanone |
| InChI Key | YNPDFBFVMJNGKZ-UHFFFAOYSA-N |
| Molecular Formula | C9H10O2 |
4-Hydroxy-3,5-dimethylbenzaldehyde 98.0+%, TCI America™
CAS: 2233-18-3 Molecular Formula: C9H10O2 Molecular Weight (g/mol): 150.18 MDL Number: MFCD00006946 InChI Key: UYGBSRJODQHNLQ-UHFFFAOYSA-N Synonym: 3,5-dimethyl-4-hydroxybenzaldehyde,benzaldehyde, 4-hydroxy-3,5-dimethyl,4-formyl-2,6-xylenol,4-hydroxy-3,5-dimethyl-benzaldehyde,unii-23pa2pmp9f,23pa2pmp9f,syringnldehyde,zlchem 510,pubchem8252,buttpark 9657-68 PubChem CID: 75222 IUPAC Name: 4-hydroxy-3,5-dimethylbenzaldehyde SMILES: CC1=CC(C=O)=CC(C)=C1O
| PubChem CID | 75222 |
|---|---|
| CAS | 2233-18-3 |
| Molecular Weight (g/mol) | 150.18 |
| MDL Number | MFCD00006946 |
| SMILES | CC1=CC(C=O)=CC(C)=C1O |
| Synonym | 3,5-dimethyl-4-hydroxybenzaldehyde,benzaldehyde, 4-hydroxy-3,5-dimethyl,4-formyl-2,6-xylenol,4-hydroxy-3,5-dimethyl-benzaldehyde,unii-23pa2pmp9f,23pa2pmp9f,syringnldehyde,zlchem 510,pubchem8252,buttpark 9657-68 |
| IUPAC Name | 4-hydroxy-3,5-dimethylbenzaldehyde |
| InChI Key | UYGBSRJODQHNLQ-UHFFFAOYSA-N |
| Molecular Formula | C9H10O2 |
Heptyl Ether 98.0+%, TCI America™
CAS: 629-64-1 Molecular Formula: C14H30O Molecular Weight (g/mol): 214.39 MDL Number: MFCD00015288 InChI Key: UJEGHEMJVNQWOJ-UHFFFAOYSA-N Synonym: Diheptyl Ether PubChem CID: 12392 IUPAC Name: 1-(heptyloxy)heptane SMILES: CCCCCCCOCCCCCCC
| PubChem CID | 12392 |
|---|---|
| CAS | 629-64-1 |
| Molecular Weight (g/mol) | 214.39 |
| MDL Number | MFCD00015288 |
| SMILES | CCCCCCCOCCCCCCC |
| Synonym | Diheptyl Ether |
| IUPAC Name | 1-(heptyloxy)heptane |
| InChI Key | UJEGHEMJVNQWOJ-UHFFFAOYSA-N |
| Molecular Formula | C14H30O |
Heptanophenone 98.0+%, TCI America™
CAS: 1671-75-6 Molecular Formula: C13H18O Molecular Weight (g/mol): 190.29 MDL Number: MFCD00009539 InChI Key: UXMQORVHJMUQFD-UHFFFAOYSA-N Synonym: heptanophenone,1-heptanone, 1-phenyl,n-heptanophenone,unii-kx07wp06jy,kx07wp06jy,enanthophenone,hexyl phenyl ketone,1-phenyl-heptan-1-one,1-phenyl-1-heptanone # PubChem CID: 74282 IUPAC Name: 1-phenylheptan-1-one SMILES: CCCCCCC(=O)C1=CC=CC=C1
| PubChem CID | 74282 |
|---|---|
| CAS | 1671-75-6 |
| Molecular Weight (g/mol) | 190.29 |
| MDL Number | MFCD00009539 |
| SMILES | CCCCCCC(=O)C1=CC=CC=C1 |
| Synonym | heptanophenone,1-heptanone, 1-phenyl,n-heptanophenone,unii-kx07wp06jy,kx07wp06jy,enanthophenone,hexyl phenyl ketone,1-phenyl-heptan-1-one,1-phenyl-1-heptanone # |
| IUPAC Name | 1-phenylheptan-1-one |
| InChI Key | UXMQORVHJMUQFD-UHFFFAOYSA-N |
| Molecular Formula | C13H18O |
Hexafluoroacetylacetone 95.0+%, TCI America™
CAS: 1522-22-1 Molecular Formula: C5H2F6O2 Molecular Weight (g/mol): 208.059 MDL Number: MFCD00000426 InChI Key: QAMFBRUWYYMMGJ-UHFFFAOYSA-N Synonym: hexafluoroacetylacetone,1,1,1,5,5,5-hexafluoroacetylacetone,1,1,1,5,5,5-hexafluoro-2,4-pentanedione,2,4-pentanedione, 1,1,1,5,5,5-hexafluoro,hexafluoro-2,4-pentanedione,hfac,1,1,1,5,5,5-hexafluoro-2,4-pentadione,1,3-bis trifluoromethyl propane-1,3-dione,1,1,1-trifluoro-3-trifluoroacetyl acetone,2,4-dioxo-1,1,1,5,5,5-hexafluoropentane PubChem CID: 73706 IUPAC Name: 1,1,1,5,5,5-hexafluoropentane-2,4-dione SMILES: C(C(=O)C(F)(F)F)C(=O)C(F)(F)F
| PubChem CID | 73706 |
|---|---|
| CAS | 1522-22-1 |
| Molecular Weight (g/mol) | 208.059 |
| MDL Number | MFCD00000426 |
| SMILES | C(C(=O)C(F)(F)F)C(=O)C(F)(F)F |
| Synonym | hexafluoroacetylacetone,1,1,1,5,5,5-hexafluoroacetylacetone,1,1,1,5,5,5-hexafluoro-2,4-pentanedione,2,4-pentanedione, 1,1,1,5,5,5-hexafluoro,hexafluoro-2,4-pentanedione,hfac,1,1,1,5,5,5-hexafluoro-2,4-pentadione,1,3-bis trifluoromethyl propane-1,3-dione,1,1,1-trifluoro-3-trifluoroacetyl acetone,2,4-dioxo-1,1,1,5,5,5-hexafluoropentane |
| IUPAC Name | 1,1,1,5,5,5-hexafluoropentane-2,4-dione |
| InChI Key | QAMFBRUWYYMMGJ-UHFFFAOYSA-N |
| Molecular Formula | C5H2F6O2 |
2'-Hydroxy-4'-methoxyacetophenone 98.0+%, TCI America™
CAS: 552-41-0 Molecular Formula: C9H10O3 Molecular Weight (g/mol): 166.176 MDL Number: MFCD00008730 InChI Key: UILPJVPSNHJFIK-UHFFFAOYSA-N Synonym: paeonol,2'-hydroxy-4'-methoxyacetophenone,1-2-hydroxy-4-methoxyphenyl ethanone,peonol,2-hydroxy-4-methoxyacetophenone,1-2-hydroxy-4-methoxyphenyl ethan-1-one,resacetophenone-4-methyl ether,ethanone, 1-2-hydroxy-4-methoxyphenyl,paeonal,paeonolum PubChem CID: 11092 ChEBI: CHEBI:69581 IUPAC Name: 1-(2-hydroxy-4-methoxyphenyl)ethanone SMILES: CC(=O)C1=C(C=C(C=C1)OC)O
| PubChem CID | 11092 |
|---|---|
| CAS | 552-41-0 |
| Molecular Weight (g/mol) | 166.176 |
| ChEBI | CHEBI:69581 |
| MDL Number | MFCD00008730 |
| SMILES | CC(=O)C1=C(C=C(C=C1)OC)O |
| Synonym | paeonol,2'-hydroxy-4'-methoxyacetophenone,1-2-hydroxy-4-methoxyphenyl ethanone,peonol,2-hydroxy-4-methoxyacetophenone,1-2-hydroxy-4-methoxyphenyl ethan-1-one,resacetophenone-4-methyl ether,ethanone, 1-2-hydroxy-4-methoxyphenyl,paeonal,paeonolum |
| IUPAC Name | 1-(2-hydroxy-4-methoxyphenyl)ethanone |
| InChI Key | UILPJVPSNHJFIK-UHFFFAOYSA-N |
| Molecular Formula | C9H10O3 |