Organooxygen compounds
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3,4-Dimethoxybenzaldehyde 98.0+%, TCI America™
CAS: 120-14-9 Molecular Formula: C9H10O3 Molecular Weight (g/mol): 166.18 MDL Number: MFCD00003363 InChI Key: WJUFSDZVCOTFON-UHFFFAOYSA-N Synonym: veratraldehyde,veratric aldehyde,methylvanillin,vanillin methyl ether,veratral,veratryl aldehyde,benzaldehyde, 3,4-dimethoxy,veratrum aldehyde,p-veratric aldehyde,4-o-methylvanillin PubChem CID: 8419 ChEBI: CHEBI:17098 IUPAC Name: 3,4-dimethoxybenzaldehyde SMILES: COC1=CC=C(C=O)C=C1OC
| PubChem CID | 8419 |
|---|---|
| CAS | 120-14-9 |
| Molecular Weight (g/mol) | 166.18 |
| ChEBI | CHEBI:17098 |
| MDL Number | MFCD00003363 |
| SMILES | COC1=CC=C(C=O)C=C1OC |
| Synonym | veratraldehyde,veratric aldehyde,methylvanillin,vanillin methyl ether,veratral,veratryl aldehyde,benzaldehyde, 3,4-dimethoxy,veratrum aldehyde,p-veratric aldehyde,4-o-methylvanillin |
| IUPAC Name | 3,4-dimethoxybenzaldehyde |
| InChI Key | WJUFSDZVCOTFON-UHFFFAOYSA-N |
| Molecular Formula | C9H10O3 |
Phenacyl 4-(Bromomethyl)phenylacetate 97.0+%, TCI America™
CAS: 66270-97-1 Molecular Formula: C17H15BrO3 Molecular Weight (g/mol): 347.21 MDL Number: MFCD00009632 InChI Key: BUQPIKAEKYNDAS-UHFFFAOYSA-N Synonym: 4-(Bromomethyl)phenylacetic Acid Phenacyl Ester PubChem CID: 570776 IUPAC Name: 2-oxo-2-phenylethyl 2-[4-(bromomethyl)phenyl]acetate SMILES: BrCC1=CC=C(CC(=O)OCC(=O)C2=CC=CC=C2)C=C1
| PubChem CID | 570776 |
|---|---|
| CAS | 66270-97-1 |
| Molecular Weight (g/mol) | 347.21 |
| MDL Number | MFCD00009632 |
| SMILES | BrCC1=CC=C(CC(=O)OCC(=O)C2=CC=CC=C2)C=C1 |
| Synonym | 4-(Bromomethyl)phenylacetic Acid Phenacyl Ester |
| IUPAC Name | 2-oxo-2-phenylethyl 2-[4-(bromomethyl)phenyl]acetate |
| InChI Key | BUQPIKAEKYNDAS-UHFFFAOYSA-N |
| Molecular Formula | C17H15BrO3 |
3-Methyl-2-buten-1-ol 98.0+%, TCI America™
CAS: 556-82-1 Molecular Formula: C5H10O Molecular Weight (g/mol): 86.13 MDL Number: MFCD00002916 InChI Key: ASUAYTHWZCLXAN-UHFFFAOYSA-N Synonym: 3-methyl-2-buten-1-ol,prenol,3,3-dimethylallyl alcohol,2-buten-1-ol, 3-methyl,prenyl alcohol,3-methyl-2-butenol,dimethylallyl alcohol,3-methyl-2-butenyl alcohol,3-methylcrotyl alcohol,3-methyl-2-butene-1-ol PubChem CID: 11173 ChEBI: CHEBI:16019 IUPAC Name: 3-methylbut-2-en-1-ol SMILES: CC(C)=CCO
| PubChem CID | 11173 |
|---|---|
| CAS | 556-82-1 |
| Molecular Weight (g/mol) | 86.13 |
| ChEBI | CHEBI:16019 |
| MDL Number | MFCD00002916 |
| SMILES | CC(C)=CCO |
| Synonym | 3-methyl-2-buten-1-ol,prenol,3,3-dimethylallyl alcohol,2-buten-1-ol, 3-methyl,prenyl alcohol,3-methyl-2-butenol,dimethylallyl alcohol,3-methyl-2-butenyl alcohol,3-methylcrotyl alcohol,3-methyl-2-butene-1-ol |
| IUPAC Name | 3-methylbut-2-en-1-ol |
| InChI Key | ASUAYTHWZCLXAN-UHFFFAOYSA-N |
| Molecular Formula | C5H10O |
1-(2-Naphthyl)ethanol 98.0+%, TCI America™
CAS: 7228-47-9 Molecular Formula: C12H12O Molecular Weight (g/mol): 172.227 MDL Number: MFCD00004111 InChI Key: AXRKCRWZRKETCK-UHFFFAOYSA-N Synonym: 1-2-naphthyl ethanol,1-naphthalen-2-yl ethanol,+/--1-2-naphthyl ethanol,1-naphthalen-2-yl ethan-1-ol,alpha-methylnaphthalene-2-methanol,.alpha.-methyl-2-naphthalenemethanol,pubchem9427,acmc-209gxz,acmc-1azul,methyl 2-naphtylcarbinol PubChem CID: 98243 IUPAC Name: 1-naphthalen-2-ylethanol SMILES: CC(C1=CC2=CC=CC=C2C=C1)O
| PubChem CID | 98243 |
|---|---|
| CAS | 7228-47-9 |
| Molecular Weight (g/mol) | 172.227 |
| MDL Number | MFCD00004111 |
| SMILES | CC(C1=CC2=CC=CC=C2C=C1)O |
| Synonym | 1-2-naphthyl ethanol,1-naphthalen-2-yl ethanol,+/--1-2-naphthyl ethanol,1-naphthalen-2-yl ethan-1-ol,alpha-methylnaphthalene-2-methanol,.alpha.-methyl-2-naphthalenemethanol,pubchem9427,acmc-209gxz,acmc-1azul,methyl 2-naphtylcarbinol |
| IUPAC Name | 1-naphthalen-2-ylethanol |
| InChI Key | AXRKCRWZRKETCK-UHFFFAOYSA-N |
| Molecular Formula | C12H12O |
Methoxyacetonitrile 98.0+%, TCI America™
CAS: 1738-36-9 Molecular Formula: C3H5NO Molecular Weight (g/mol): 71.08 MDL Number: MFCD00001892 InChI Key: QKPVEISEHYYHRH-UHFFFAOYSA-N PubChem CID: 74442 IUPAC Name: 2-methoxyacetonitrile SMILES: COCC#N
| PubChem CID | 74442 |
|---|---|
| CAS | 1738-36-9 |
| Molecular Weight (g/mol) | 71.08 |
| MDL Number | MFCD00001892 |
| SMILES | COCC#N |
| IUPAC Name | 2-methoxyacetonitrile |
| InChI Key | QKPVEISEHYYHRH-UHFFFAOYSA-N |
| Molecular Formula | C3H5NO |
2',4'-Dichloroacetophenone 98.0+%, TCI America™
CAS: 2234-16-4 Molecular Formula: C8H6Cl2O Molecular Weight (g/mol): 189.035 MDL Number: MFCD00000581 InChI Key: XMCRWEBERCXJCH-UHFFFAOYSA-N Synonym: 2',4'-dichloroacetophenone,1-2,4-dichlorophenyl ethanone,2,4-dichloroacetophenone,ethanone, 1-2,4-dichlorophenyl,1-2,4-dichlorophenyl ethan-1-one,p-chloro-2-chloroacetophenone,acetophenone, 2',4'-dichloro,unii-t7f2608h5h,2',4'-dichloro phenyl ethanone,1-2,4-dichloro-phenyl-ethanone PubChem CID: 16693 IUPAC Name: 1-(2,4-dichlorophenyl)ethanone SMILES: CC(=O)C1=C(C=C(C=C1)Cl)Cl
| PubChem CID | 16693 |
|---|---|
| CAS | 2234-16-4 |
| Molecular Weight (g/mol) | 189.035 |
| MDL Number | MFCD00000581 |
| SMILES | CC(=O)C1=C(C=C(C=C1)Cl)Cl |
| Synonym | 2',4'-dichloroacetophenone,1-2,4-dichlorophenyl ethanone,2,4-dichloroacetophenone,ethanone, 1-2,4-dichlorophenyl,1-2,4-dichlorophenyl ethan-1-one,p-chloro-2-chloroacetophenone,acetophenone, 2',4'-dichloro,unii-t7f2608h5h,2',4'-dichloro phenyl ethanone,1-2,4-dichloro-phenyl-ethanone |
| IUPAC Name | 1-(2,4-dichlorophenyl)ethanone |
| InChI Key | XMCRWEBERCXJCH-UHFFFAOYSA-N |
| Molecular Formula | C8H6Cl2O |
Isovanillin 98.0+%, TCI America™
CAS: 621-59-0 Molecular Formula: C8H8O3 Molecular Weight (g/mol): 152.149 MDL Number: MFCD00003369 InChI Key: JVTZFYYHCGSXJV-UHFFFAOYSA-N Synonym: isovanillin,isovanilline,3-hydroxy-p-anisaldehyde,5-formylguaiacol,benzaldehyde, 3-hydroxy-4-methoxy,iso-vanillin,3-hydroxyanisaldehyde,isovanilin,isovanicaline,3-hydroxy-4-methoxy-benzaldehyde PubChem CID: 12127 IUPAC Name: 3-hydroxy-4-methoxybenzaldehyde SMILES: COC1=C(C=C(C=C1)C=O)O
| PubChem CID | 12127 |
|---|---|
| CAS | 621-59-0 |
| Molecular Weight (g/mol) | 152.149 |
| MDL Number | MFCD00003369 |
| SMILES | COC1=C(C=C(C=C1)C=O)O |
| Synonym | isovanillin,isovanilline,3-hydroxy-p-anisaldehyde,5-formylguaiacol,benzaldehyde, 3-hydroxy-4-methoxy,iso-vanillin,3-hydroxyanisaldehyde,isovanilin,isovanicaline,3-hydroxy-4-methoxy-benzaldehyde |
| IUPAC Name | 3-hydroxy-4-methoxybenzaldehyde |
| InChI Key | JVTZFYYHCGSXJV-UHFFFAOYSA-N |
| Molecular Formula | C8H8O3 |
tert-Amyl Ethyl Ether 98.0+%, TCI America™
CAS: 919-94-8 Molecular Formula: C7H16O Molecular Weight (g/mol): 116.204 MDL Number: MFCD01727266 InChI Key: KFRVYYGHSPLXSZ-UHFFFAOYSA-N Synonym: 1,1-Dimethylpropyl Ethyl Ether, Ethyl tert-Pentyl Ether PubChem CID: 13527 IUPAC Name: 2-ethoxy-2-methylbutane SMILES: CCC(C)(C)OCC
| PubChem CID | 13527 |
|---|---|
| CAS | 919-94-8 |
| Molecular Weight (g/mol) | 116.204 |
| MDL Number | MFCD01727266 |
| SMILES | CCC(C)(C)OCC |
| Synonym | 1,1-Dimethylpropyl Ethyl Ether, Ethyl tert-Pentyl Ether |
| IUPAC Name | 2-ethoxy-2-methylbutane |
| InChI Key | KFRVYYGHSPLXSZ-UHFFFAOYSA-N |
| Molecular Formula | C7H16O |
Indole-5-carboxaldehyde 98.0+%, TCI America™
CAS: 1196-69-6 Molecular Formula: C9H7NO Molecular Weight (g/mol): 145.161 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) | 145.161 |
| 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 |
2-Methoxypyridine 98.0+%, TCI America™
CAS: 1628-89-3 Molecular Formula: C6H7NO Molecular Weight (g/mol): 109.13 MDL Number: MFCD00006262 InChI Key: IWTFOFMTUOBLHG-UHFFFAOYSA-N Synonym: pyridine, 2-methoxy,2-methoxy pyridine,pyridine, methoxy,2-methoxy-pyridine,unii-geb38j8108,methyl 2-pyridyl ether,methoxypyridine,6-methoxypyridine,methyl pyridinyl ether,pubchem13201 PubChem CID: 74201 IUPAC Name: 2-methoxypyridine SMILES: COC1=CC=CC=N1
| PubChem CID | 74201 |
|---|---|
| CAS | 1628-89-3 |
| Molecular Weight (g/mol) | 109.13 |
| MDL Number | MFCD00006262 |
| SMILES | COC1=CC=CC=N1 |
| Synonym | pyridine, 2-methoxy,2-methoxy pyridine,pyridine, methoxy,2-methoxy-pyridine,unii-geb38j8108,methyl 2-pyridyl ether,methoxypyridine,6-methoxypyridine,methyl pyridinyl ether,pubchem13201 |
| IUPAC Name | 2-methoxypyridine |
| InChI Key | IWTFOFMTUOBLHG-UHFFFAOYSA-N |
| Molecular Formula | C6H7NO |
Prostaglandin E2 98.0+%, TCI America™
CAS: 363-24-6 Molecular Formula: C20H32O5 Molecular Weight (g/mol): 352.471 MDL Number: MFCD00077861 InChI Key: XEYBRNLFEZDVAW-ARSRFYASSA-N Synonym: prostaglandin e2,dinoprostone,pge2,prostin e2,prepidil,cervidil,propess,minprositin e2,minprostin e2,dinoproston PubChem CID: 5280360 ChEBI: CHEBI:15551 IUPAC Name: (Z)-7-[(1R,2R,3R)-3-hydroxy-2-[(E,3S)-3-hydroxyoct-1-enyl]-5-oxocyclopentyl]hept-5-enoic acid SMILES: CCCCCC(C=CC1C(CC(=O)C1CC=CCCCC(=O)O)O)O
| PubChem CID | 5280360 |
|---|---|
| CAS | 363-24-6 |
| Molecular Weight (g/mol) | 352.471 |
| ChEBI | CHEBI:15551 |
| MDL Number | MFCD00077861 |
| SMILES | CCCCCC(C=CC1C(CC(=O)C1CC=CCCCC(=O)O)O)O |
| Synonym | prostaglandin e2,dinoprostone,pge2,prostin e2,prepidil,cervidil,propess,minprositin e2,minprostin e2,dinoproston |
| IUPAC Name | (Z)-7-[(1R,2R,3R)-3-hydroxy-2-[(E,3S)-3-hydroxyoct-1-enyl]-5-oxocyclopentyl]hept-5-enoic acid |
| InChI Key | XEYBRNLFEZDVAW-ARSRFYASSA-N |
| Molecular Formula | C20H32O5 |
2-(4-Piperidyl)-2-propanol 98.0+%, TCI America™
CAS: 22990-34-7 Molecular Formula: C8H17NO Molecular Weight (g/mol): 143.23 MDL Number: MFCD06797159 InChI Key: IIXYTWTZMGUQPT-UHFFFAOYSA-N Synonym: 2-(4-Piperidyl)isopropyl Alcohol PubChem CID: 5200321 IUPAC Name: 2-(piperidin-4-yl)propan-2-ol SMILES: CC(C)(O)C1CCNCC1
| PubChem CID | 5200321 |
|---|---|
| CAS | 22990-34-7 |
| Molecular Weight (g/mol) | 143.23 |
| MDL Number | MFCD06797159 |
| SMILES | CC(C)(O)C1CCNCC1 |
| Synonym | 2-(4-Piperidyl)isopropyl Alcohol |
| IUPAC Name | 2-(piperidin-4-yl)propan-2-ol |
| InChI Key | IIXYTWTZMGUQPT-UHFFFAOYSA-N |
| Molecular Formula | C8H17NO |
Oxalacetic Acid 97.0+%, TCI America™
CAS: 328-42-7 Molecular Formula: C4H4O5 Molecular Weight (g/mol): 132.071 MDL Number: MFCD00002592 InChI Key: KHPXUQMNIQBQEV-UHFFFAOYSA-N Synonym: oxalacetic acid,oxaloacetic acid,2-oxosuccinic acid,oxaloacetate,ketosuccinic acid,oxosuccinic acid,2-ketosuccinic acid,butanedioic acid, oxo,oxobutanedioic acid,oxalacetate PubChem CID: 970 ChEBI: CHEBI:30744 IUPAC Name: 2-oxobutanedioic acid SMILES: C(C(=O)C(=O)O)C(=O)O
| PubChem CID | 970 |
|---|---|
| CAS | 328-42-7 |
| Molecular Weight (g/mol) | 132.071 |
| ChEBI | CHEBI:30744 |
| MDL Number | MFCD00002592 |
| SMILES | C(C(=O)C(=O)O)C(=O)O |
| Synonym | oxalacetic acid,oxaloacetic acid,2-oxosuccinic acid,oxaloacetate,ketosuccinic acid,oxosuccinic acid,2-ketosuccinic acid,butanedioic acid, oxo,oxobutanedioic acid,oxalacetate |
| IUPAC Name | 2-oxobutanedioic acid |
| InChI Key | KHPXUQMNIQBQEV-UHFFFAOYSA-N |
| Molecular Formula | C4H4O5 |
Propionaldehyde 98.0+%, TCI America™
CAS: 123-38-6 Molecular Formula: C3H6O Molecular Weight (g/mol): 58.08 MDL Number: MFCD00007020 InChI Key: NBBJYMSMWIIQGU-UHFFFAOYSA-N Synonym: propionaldehyde,propanaldehyde,propaldehyde,propional,propionic aldehyde,n-propanal,methylacetaldehyde,propylaldehyde,propylic aldehyde,aldehyde propionique PubChem CID: 527 ChEBI: CHEBI:17153 IUPAC Name: propanal SMILES: CCC=O
| PubChem CID | 527 |
|---|---|
| CAS | 123-38-6 |
| Molecular Weight (g/mol) | 58.08 |
| ChEBI | CHEBI:17153 |
| MDL Number | MFCD00007020 |
| SMILES | CCC=O |
| Synonym | propionaldehyde,propanaldehyde,propaldehyde,propional,propionic aldehyde,n-propanal,methylacetaldehyde,propylaldehyde,propylic aldehyde,aldehyde propionique |
| IUPAC Name | propanal |
| InChI Key | NBBJYMSMWIIQGU-UHFFFAOYSA-N |
| Molecular Formula | C3H6O |
3-Methoxy-1-propanol 98.0+%, TCI America™
CAS: 1589-49-7 Molecular Formula: C4H10O2 Molecular Weight (g/mol): 90.122 MDL Number: MFCD00039550 InChI Key: JDFDHBSESGTDAL-UHFFFAOYSA-N Synonym: 3-methoxy-1-propanol,1-propanol, 3-methoxy,3-methoxypropanol,trimethylene glycol monomethyl ether,beta-pgme,1,3-propanediol monomethyl ether,unii-oak281wz1p,propylene glycol monomethyl ether, beta,oak281wz1p,mpol PubChem CID: 74116 IUPAC Name: 3-methoxypropan-1-ol SMILES: COCCCO
| PubChem CID | 74116 |
|---|---|
| CAS | 1589-49-7 |
| Molecular Weight (g/mol) | 90.122 |
| MDL Number | MFCD00039550 |
| SMILES | COCCCO |
| Synonym | 3-methoxy-1-propanol,1-propanol, 3-methoxy,3-methoxypropanol,trimethylene glycol monomethyl ether,beta-pgme,1,3-propanediol monomethyl ether,unii-oak281wz1p,propylene glycol monomethyl ether, beta,oak281wz1p,mpol |
| IUPAC Name | 3-methoxypropan-1-ol |
| InChI Key | JDFDHBSESGTDAL-UHFFFAOYSA-N |
| Molecular Formula | C4H10O2 |