Organooxygen compounds
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1-Adamantanol 98.0+%, TCI America™
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CAS: 768-95-6 Molecular Formula: C10H16O Molecular Weight (g/mol): 152.237 MDL Number: MFCD00074729 InChI Key: VLLNJDMHDJRNFK-UHFFFAOYSA-N Synonym: 1-adamantanol,1-hydroxyadamantane,1-adamantol,adamantanol,tricyclo 3.3.1.1 3,7 decan-1-ol,tricyclo 3.3.1.1∼3,7∼ decan-1-ol,1-adamantanol 1-hydroxyadamantane,tricyclo 3.3.1.13,7 decan-1-ol,3r,5s,7s-adamantan-1-ol PubChem CID: 64152 IUPAC Name: adamantan-1-ol SMILES: C1C2CC3CC1CC(C2)(C3)O
| PubChem CID | 64152 |
|---|---|
| CAS | 768-95-6 |
| Molecular Weight (g/mol) | 152.237 |
| MDL Number | MFCD00074729 |
| SMILES | C1C2CC3CC1CC(C2)(C3)O |
| Synonym | 1-adamantanol,1-hydroxyadamantane,1-adamantol,adamantanol,tricyclo 3.3.1.1 3,7 decan-1-ol,tricyclo 3.3.1.1∼3,7∼ decan-1-ol,1-adamantanol 1-hydroxyadamantane,tricyclo 3.3.1.13,7 decan-1-ol,3r,5s,7s-adamantan-1-ol |
| IUPAC Name | adamantan-1-ol |
| InChI Key | VLLNJDMHDJRNFK-UHFFFAOYSA-N |
| Molecular Formula | C10H16O |
2-Acetyl-5-methylthiophene 96.0+%, TCI America™
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CAS: 13679-74-8 Molecular Formula: C7H8OS Molecular Weight (g/mol): 140.20 MDL Number: MFCD00014529 InChI Key: YOSDTJYMDAEEAZ-UHFFFAOYSA-N Synonym: 2-acetyl-5-methylthiophene,1-5-methylthiophen-2-yl ethanone,ketone, methyl 5-methyl-2-thienyl,1-5-methyl-2-thienyl ethan-1-one,2-methyl-5-acetylthiophene,ethanone, 1-5-methyl-2-thienyl,methylthienylcetone,1-5-methyl-2-thienyl ethanone,5-methyl-2-acetylthiophene,methyl 5-methyl-2-thienyl ketone PubChem CID: 83655 IUPAC Name: 1-(5-methylthiophen-2-yl)ethan-1-one SMILES: CC(=O)C1=CC=C(C)S1
| PubChem CID | 83655 |
|---|---|
| CAS | 13679-74-8 |
| Molecular Weight (g/mol) | 140.20 |
| MDL Number | MFCD00014529 |
| SMILES | CC(=O)C1=CC=C(C)S1 |
| Synonym | 2-acetyl-5-methylthiophene,1-5-methylthiophen-2-yl ethanone,ketone, methyl 5-methyl-2-thienyl,1-5-methyl-2-thienyl ethan-1-one,2-methyl-5-acetylthiophene,ethanone, 1-5-methyl-2-thienyl,methylthienylcetone,1-5-methyl-2-thienyl ethanone,5-methyl-2-acetylthiophene,methyl 5-methyl-2-thienyl ketone |
| IUPAC Name | 1-(5-methylthiophen-2-yl)ethan-1-one |
| InChI Key | YOSDTJYMDAEEAZ-UHFFFAOYSA-N |
| Molecular Formula | C7H8OS |
Adrenalone Hydrochloride Hydrate 98.0+%, TCI America™
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CAS: 62-13-5 Molecular Formula: C9H12ClNO3 Molecular Weight (g/mol): 217.649 MDL Number: MFCD00035075 InChI Key: CSRRBDMYOUQTCO-UHFFFAOYSA-N Synonym: adrenalone hydrochloride,stryphnonasal,adrenone hydrochloride,adrenalone hcl,kephrine hydrochloride,adrenalonium chloratum,epinephrine ketone hydrochloride,3',4'-dihydroxy-2-methylamino acetophenone hydrochloride,unii-nn82ywe2ic PubChem CID: 66136 IUPAC Name: 1-(3,4-dihydroxyphenyl)-2-(methylamino)ethanone;hydrochloride SMILES: CNCC(=O)C1=CC(=C(C=C1)O)O.Cl
| PubChem CID | 66136 |
|---|---|
| CAS | 62-13-5 |
| Molecular Weight (g/mol) | 217.649 |
| MDL Number | MFCD00035075 |
| SMILES | CNCC(=O)C1=CC(=C(C=C1)O)O.Cl |
| Synonym | adrenalone hydrochloride,stryphnonasal,adrenone hydrochloride,adrenalone hcl,kephrine hydrochloride,adrenalonium chloratum,epinephrine ketone hydrochloride,3',4'-dihydroxy-2-methylamino acetophenone hydrochloride,unii-nn82ywe2ic |
| IUPAC Name | 1-(3,4-dihydroxyphenyl)-2-(methylamino)ethanone;hydrochloride |
| InChI Key | CSRRBDMYOUQTCO-UHFFFAOYSA-N |
| Molecular Formula | C9H12ClNO3 |
1,4-Diaminoanthraquinone 90.0+%, TCI America™
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Ethyl 3-Phenylglycidate (cis- and trans- mixture) 90.0+%, TCI America™
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CAS: 121-39-1 Molecular Formula: C11H12O3 Molecular Weight (g/mol): 192.214 MDL Number: MFCD00005123 InChI Key: GOMAKLPNAAZVCJ-UHFFFAOYSA-N Synonym: ethyl 3-phenylglycidate,ethyl phenylglycidate,oxiranecarboxylic acid, 3-phenyl-, ethyl ester,ethyl 2,3-epoxy-3-phenylpropionate,ethyl 3-phenyloxiranecarboxylate,glycidic acid, 3-phenyl-, ethyl ester,2-ethyl-3-phenylglycidate,fema no. 2454,ccris 2623,ethyl3-phenylglycidate PubChem CID: 8469 IUPAC Name: ethyl 3-phenyloxirane-2-carboxylate SMILES: CCOC(=O)C1C(O1)C2=CC=CC=C2
| PubChem CID | 8469 |
|---|---|
| CAS | 121-39-1 |
| Molecular Weight (g/mol) | 192.214 |
| MDL Number | MFCD00005123 |
| SMILES | CCOC(=O)C1C(O1)C2=CC=CC=C2 |
| Synonym | ethyl 3-phenylglycidate,ethyl phenylglycidate,oxiranecarboxylic acid, 3-phenyl-, ethyl ester,ethyl 2,3-epoxy-3-phenylpropionate,ethyl 3-phenyloxiranecarboxylate,glycidic acid, 3-phenyl-, ethyl ester,2-ethyl-3-phenylglycidate,fema no. 2454,ccris 2623,ethyl3-phenylglycidate |
| IUPAC Name | ethyl 3-phenyloxirane-2-carboxylate |
| InChI Key | GOMAKLPNAAZVCJ-UHFFFAOYSA-N |
| Molecular Formula | C11H12O3 |
3-Ethoxysalicylaldehyde 97.0+%, TCI America™
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CAS: 492-88-6 Molecular Formula: C9H10O3 Molecular Weight (g/mol): 166.176 MDL Number: MFCD00003323 InChI Key: OFQBYHLLIJGMNP-UHFFFAOYSA-N Synonym: 3-ethoxysalicylaldehyde,benzaldehyde, 3-ethoxy-2-hydroxy,novovanillin,o-ethylvanillin,salicylaldehyde, 3-ethoxy,unii-hb4h48mkni,2-hydroxy-3-ethoxybenzaldehyde,hb4h48mkni,3-ethoxy-2-hydroxy-benzaldehyde,pubchem3123 PubChem CID: 68117 IUPAC Name: 3-ethoxy-2-hydroxybenzaldehyde SMILES: CCOC1=CC=CC(=C1O)C=O
| PubChem CID | 68117 |
|---|---|
| CAS | 492-88-6 |
| Molecular Weight (g/mol) | 166.176 |
| MDL Number | MFCD00003323 |
| SMILES | CCOC1=CC=CC(=C1O)C=O |
| Synonym | 3-ethoxysalicylaldehyde,benzaldehyde, 3-ethoxy-2-hydroxy,novovanillin,o-ethylvanillin,salicylaldehyde, 3-ethoxy,unii-hb4h48mkni,2-hydroxy-3-ethoxybenzaldehyde,hb4h48mkni,3-ethoxy-2-hydroxy-benzaldehyde,pubchem3123 |
| IUPAC Name | 3-ethoxy-2-hydroxybenzaldehyde |
| InChI Key | OFQBYHLLIJGMNP-UHFFFAOYSA-N |
| Molecular Formula | C9H10O3 |
2'-Ethoxyacetophenone 98.0+%, TCI America™
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CAS: 2142-67-8 Molecular Formula: C10H12O2 Molecular Weight (g/mol): 164.204 MDL Number: MFCD00017262 InChI Key: TVGMOUGXQYQZOL-UHFFFAOYSA-N Synonym: 2'-ethoxyacetophenone,1-2-ethoxyphenyl ethanone,ethanone, 1-2-ethoxyphenyl,2-acetylphenetole,1-2-ethoxyphenyl ethan-1-one,1-acetyl-2-ethoxybenzene,o-ethoxyacetophenone,pubchem13191,acmc-1bt18,ethanone,2-ethoxy-1-phenyl PubChem CID: 578482 IUPAC Name: 1-(2-ethoxyphenyl)ethanone SMILES: CCOC1=CC=CC=C1C(=O)C
| PubChem CID | 578482 |
|---|---|
| CAS | 2142-67-8 |
| Molecular Weight (g/mol) | 164.204 |
| MDL Number | MFCD00017262 |
| SMILES | CCOC1=CC=CC=C1C(=O)C |
| Synonym | 2'-ethoxyacetophenone,1-2-ethoxyphenyl ethanone,ethanone, 1-2-ethoxyphenyl,2-acetylphenetole,1-2-ethoxyphenyl ethan-1-one,1-acetyl-2-ethoxybenzene,o-ethoxyacetophenone,pubchem13191,acmc-1bt18,ethanone,2-ethoxy-1-phenyl |
| IUPAC Name | 1-(2-ethoxyphenyl)ethanone |
| InChI Key | TVGMOUGXQYQZOL-UHFFFAOYSA-N |
| Molecular Formula | C10H12O2 |
4-Bromoindole-3-carboxaldehyde 96.0+%, TCI America™
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CAS: 98600-34-1 Molecular Formula: C9H6BrNO Molecular Weight (g/mol): 224.057 InChI Key: IPAFHZDRYAWZOB-UHFFFAOYSA-N Synonym: 4-bromoindole-3-carboxaldehyde,4-bromoindole-3-carboxyaldehyde,4-bromo-3-formylindole,4-bromo-1h-indole-3-carboxaldehyde,4-bromoindole-3-carbaldehyde,4-bromo-3-formyl-1h-indole,1h-indole-3-carboxaldehyde, 4-bromo,4-bromo-3-indolecarbaldehyde,pubchem7682,acmc-209saq PubChem CID: 2763178 IUPAC Name: 4-bromo-1H-indole-3-carbaldehyde SMILES: C1=CC2=C(C(=C1)Br)C(=CN2)C=O
| PubChem CID | 2763178 |
|---|---|
| CAS | 98600-34-1 |
| Molecular Weight (g/mol) | 224.057 |
| SMILES | C1=CC2=C(C(=C1)Br)C(=CN2)C=O |
| Synonym | 4-bromoindole-3-carboxaldehyde,4-bromoindole-3-carboxyaldehyde,4-bromo-3-formylindole,4-bromo-1h-indole-3-carboxaldehyde,4-bromoindole-3-carbaldehyde,4-bromo-3-formyl-1h-indole,1h-indole-3-carboxaldehyde, 4-bromo,4-bromo-3-indolecarbaldehyde,pubchem7682,acmc-209saq |
| IUPAC Name | 4-bromo-1H-indole-3-carbaldehyde |
| InChI Key | IPAFHZDRYAWZOB-UHFFFAOYSA-N |
| Molecular Formula | C9H6BrNO |
Ethyl (3-Methoxybenzoyl)acetate 98.0+%, TCI America™
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CAS: 27834-99-7 Molecular Formula: C12H14O4 Molecular Weight (g/mol): 222.24 MDL Number: MFCD00086704 InChI Key: FDPPVAYPZOORBP-UHFFFAOYSA-N Synonym: (3-Methoxybenzoyl)acetic Acid Ethyl Ester, Ethyl 3-(3-Methoxyphenyl)-3-oxopropionate, 3-(3-Methoxyphenyl)-3-oxopropionic Acid Ethyl Ester PubChem CID: 2759696 IUPAC Name: ethyl 3-(3-methoxyphenyl)-3-oxopropanoate SMILES: CCOC(=O)CC(=O)C1=CC(OC)=CC=C1
| PubChem CID | 2759696 |
|---|---|
| CAS | 27834-99-7 |
| Molecular Weight (g/mol) | 222.24 |
| MDL Number | MFCD00086704 |
| SMILES | CCOC(=O)CC(=O)C1=CC(OC)=CC=C1 |
| Synonym | (3-Methoxybenzoyl)acetic Acid Ethyl Ester, Ethyl 3-(3-Methoxyphenyl)-3-oxopropionate, 3-(3-Methoxyphenyl)-3-oxopropionic Acid Ethyl Ester |
| IUPAC Name | ethyl 3-(3-methoxyphenyl)-3-oxopropanoate |
| InChI Key | FDPPVAYPZOORBP-UHFFFAOYSA-N |
| Molecular Formula | C12H14O4 |
Allyl (3-Methylbutoxy)acetate 98.0+%, TCI America™
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CAS: 67634-00-8 Molecular Formula: C10H18O3 Molecular Weight (g/mol): 186.251 MDL Number: MFCD03424212 InChI Key: XCWPXUNHSPOFGV-UHFFFAOYSA-N Synonym: (3-Methylbutoxy)acetic Acid Allyl Ester PubChem CID: 106729 IUPAC Name: prop-2-enyl 2-(3-methylbutoxy)acetate SMILES: CC(C)CCOCC(=O)OCC=C
| PubChem CID | 106729 |
|---|---|
| CAS | 67634-00-8 |
| Molecular Weight (g/mol) | 186.251 |
| MDL Number | MFCD03424212 |
| SMILES | CC(C)CCOCC(=O)OCC=C |
| Synonym | (3-Methylbutoxy)acetic Acid Allyl Ester |
| IUPAC Name | prop-2-enyl 2-(3-methylbutoxy)acetate |
| InChI Key | XCWPXUNHSPOFGV-UHFFFAOYSA-N |
| Molecular Formula | C10H18O3 |
Diethyl Acetonylmalonate 95.0+%, TCI America™
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CAS: 23193-18-2 Molecular Formula: C10H16O5 Molecular Weight (g/mol): 216.233 MDL Number: MFCD00177949 InChI Key: KGZCSZOGMMZHKB-UHFFFAOYSA-N Synonym: Acetonylmalonic Acid Diethyl Ester, Diethyl 2-Oxopropylmalonate, 2-Oxopropylmalonic Acid Diethyl Ester PubChem CID: 12000252 IUPAC Name: diethyl 2-(2-oxopropyl)propanedioate SMILES: CCOC(=O)C(CC(=O)C)C(=O)OCC
| PubChem CID | 12000252 |
|---|---|
| CAS | 23193-18-2 |
| Molecular Weight (g/mol) | 216.233 |
| MDL Number | MFCD00177949 |
| SMILES | CCOC(=O)C(CC(=O)C)C(=O)OCC |
| Synonym | Acetonylmalonic Acid Diethyl Ester, Diethyl 2-Oxopropylmalonate, 2-Oxopropylmalonic Acid Diethyl Ester |
| IUPAC Name | diethyl 2-(2-oxopropyl)propanedioate |
| InChI Key | KGZCSZOGMMZHKB-UHFFFAOYSA-N |
| Molecular Formula | C10H16O5 |
Acetaldehyde (ca. 2% in N,N-Dimethylformamide) [for Detection of Primary and Secondary Amines], TCI America™
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CAS: 75-07-0 Molecular Formula: C2H4O Molecular Weight (g/mol): 44.053 MDL Number: MFCD00006991 InChI Key: IKHGUXGNUITLKF-UHFFFAOYSA-N Synonym: ethanal,acetic aldehyde,ethyl aldehyde,acetaldehyd,acetylaldehyde,aldehyde,acetic ethanol,aldeide acetica,octowy aldehyd,aldehyde acetique PubChem CID: 177 ChEBI: CHEBI:15343 IUPAC Name: acetaldehyde SMILES: CC=O
| PubChem CID | 177 |
|---|---|
| CAS | 75-07-0 |
| Molecular Weight (g/mol) | 44.053 |
| ChEBI | CHEBI:15343 |
| MDL Number | MFCD00006991 |
| SMILES | CC=O |
| Synonym | ethanal,acetic aldehyde,ethyl aldehyde,acetaldehyd,acetylaldehyde,aldehyde,acetic ethanol,aldeide acetica,octowy aldehyd,aldehyde acetique |
| IUPAC Name | acetaldehyde |
| InChI Key | IKHGUXGNUITLKF-UHFFFAOYSA-N |
| Molecular Formula | C2H4O |
2-(2-Aminophenyl)ethanol 95.0+%, TCI America™
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CAS: 5339-85-5 Molecular Formula: C8H11NO Molecular Weight (g/mol): 137.182 MDL Number: MFCD00007754 InChI Key: ILDXSRFKXABMHH-UHFFFAOYSA-N Synonym: 2-(2-Aminophenyl)ethyl Alcohol, 2-Aminophenethyl Alcohol PubChem CID: 79282 IUPAC Name: 2-(2-aminophenyl)ethanol SMILES: C1=CC=C(C(=C1)CCO)N
| PubChem CID | 79282 |
|---|---|
| CAS | 5339-85-5 |
| Molecular Weight (g/mol) | 137.182 |
| MDL Number | MFCD00007754 |
| SMILES | C1=CC=C(C(=C1)CCO)N |
| Synonym | 2-(2-Aminophenyl)ethyl Alcohol, 2-Aminophenethyl Alcohol |
| IUPAC Name | 2-(2-aminophenyl)ethanol |
| InChI Key | ILDXSRFKXABMHH-UHFFFAOYSA-N |
| Molecular Formula | C8H11NO |
Fluoromethyl 1,1,1,3,3,3-Hexafluoroisopropyl Ether 98.0+%, TCI America™
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CAS: 28523-86-6 Molecular Formula: C4H3F7O Molecular Weight (g/mol): 200.056 MDL Number: MFCD00153189 InChI Key: DFEYYRMXOJXZRJ-UHFFFAOYSA-N Synonym: sevoflurane,sevofluran,ultane,1,1,1,3,3,3-hexafluoro-2-fluoromethoxy propane,sevoflurano,sevofluranum,sevorane,sojourn,mr6s4,sevofluranum inn-latin PubChem CID: 5206 ChEBI: CHEBI:9130 IUPAC Name: 1,1,1,3,3,3-hexafluoro-2-(fluoromethoxy)propane SMILES: C(OC(C(F)(F)F)C(F)(F)F)F
| PubChem CID | 5206 |
|---|---|
| CAS | 28523-86-6 |
| Molecular Weight (g/mol) | 200.056 |
| ChEBI | CHEBI:9130 |
| MDL Number | MFCD00153189 |
| SMILES | C(OC(C(F)(F)F)C(F)(F)F)F |
| Synonym | sevoflurane,sevofluran,ultane,1,1,1,3,3,3-hexafluoro-2-fluoromethoxy propane,sevoflurano,sevofluranum,sevorane,sojourn,mr6s4,sevofluranum inn-latin |
| IUPAC Name | 1,1,1,3,3,3-hexafluoro-2-(fluoromethoxy)propane |
| InChI Key | DFEYYRMXOJXZRJ-UHFFFAOYSA-N |
| Molecular Formula | C4H3F7O |
4-Methoxypyridine 98.0+%, TCI America™
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CAS: 620-08-6 Molecular Formula: C6H7NO Molecular Weight (g/mol): 109.128 InChI Key: XQABVLBGNWBWIV-UHFFFAOYSA-N Synonym: pyridine, 4-methoxy,methyl pyridin-4-yl ether,4-methoxy pyridine,.gamma.-methoxypyridine,4-methoxypyridin,4-methoxypyrdine,4-methoxylpyridine,4-methoxy-pyridine,4-methoxypyridine,pubchem2585 PubChem CID: 69278 IUPAC Name: 4-methoxypyridine SMILES: COC1=CC=NC=C1
| PubChem CID | 69278 |
|---|---|
| CAS | 620-08-6 |
| Molecular Weight (g/mol) | 109.128 |
| SMILES | COC1=CC=NC=C1 |
| Synonym | pyridine, 4-methoxy,methyl pyridin-4-yl ether,4-methoxy pyridine,.gamma.-methoxypyridine,4-methoxypyridin,4-methoxypyrdine,4-methoxylpyridine,4-methoxy-pyridine,4-methoxypyridine,pubchem2585 |
| IUPAC Name | 4-methoxypyridine |
| InChI Key | XQABVLBGNWBWIV-UHFFFAOYSA-N |
| Molecular Formula | C6H7NO |