Organooxygen compounds
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Methyl 2-oxocyclohexanecarboxylate, 90%
CAS: 41302-34-5 Molecular Formula: C8H12O3 Molecular Weight (g/mol): 156.2 MDL Number: MFCD00077699 InChI Key: JEENWEAPRWGXSG-UHFFFAOYSA-N Synonym: methyl 2-oxocyclohexanecarboxylate,2-methoxycarbonylcyclohexanone,2-carbomethoxycyclohexanone,cyclohexanecarboxylic acid, 2-oxo-, methyl ester,methyl cyclohexanone-2-carboxylate,2-oxo-cyclohexanecarboxylic acid methyl ester,2-hydroxy methyl cyclohexanone,2-oxocyclohexanecarboxylic acid, methyl ester,pubchem20380,acmc-1ao3u PubChem CID: 170489 IUPAC Name: methyl 2-oxocyclohexane-1-carboxylate SMILES: COC(=O)C1CCCCC1=O
| PubChem CID | 170489 |
|---|---|
| CAS | 41302-34-5 |
| Molecular Weight (g/mol) | 156.2 |
| MDL Number | MFCD00077699 |
| SMILES | COC(=O)C1CCCCC1=O |
| Synonym | methyl 2-oxocyclohexanecarboxylate,2-methoxycarbonylcyclohexanone,2-carbomethoxycyclohexanone,cyclohexanecarboxylic acid, 2-oxo-, methyl ester,methyl cyclohexanone-2-carboxylate,2-oxo-cyclohexanecarboxylic acid methyl ester,2-hydroxy methyl cyclohexanone,2-oxocyclohexanecarboxylic acid, methyl ester,pubchem20380,acmc-1ao3u |
| IUPAC Name | methyl 2-oxocyclohexane-1-carboxylate |
| InChI Key | JEENWEAPRWGXSG-UHFFFAOYSA-N |
| Molecular Formula | C8H12O3 |
DL-sec-Phenethyl alcohol, 97%
CAS: 98-85-1 Molecular Formula: C8H10O Molecular Weight (g/mol): 122.17 MDL Number: MFCD00004508 InChI Key: WAPNOHKVXSQRPX-UHFFFAOYSA-N Synonym: methylphenyl carbinol,1-phenylethan-1-ol,alpha-methylbenzyl alcohol,styralyl alcohol,1-phenethyl alcohol,styrallyl alcohol,methylphenylcarbinol,1-phenylethyl alcohol,phenylmethylcarbinol,1-hydroxyethyl benzene PubChem CID: 7409 ChEBI: CHEBI:669 IUPAC Name: 1-phenylethanol SMILES: CC(C1=CC=CC=C1)O
| PubChem CID | 7409 |
|---|---|
| CAS | 98-85-1 |
| Molecular Weight (g/mol) | 122.17 |
| ChEBI | CHEBI:669 |
| MDL Number | MFCD00004508 |
| SMILES | CC(C1=CC=CC=C1)O |
| Synonym | methylphenyl carbinol,1-phenylethan-1-ol,alpha-methylbenzyl alcohol,styralyl alcohol,1-phenethyl alcohol,styrallyl alcohol,methylphenylcarbinol,1-phenylethyl alcohol,phenylmethylcarbinol,1-hydroxyethyl benzene |
| IUPAC Name | 1-phenylethanol |
| InChI Key | WAPNOHKVXSQRPX-UHFFFAOYSA-N |
| Molecular Formula | C8H10O |
(R)-2-(1-Hydroxyethyl)pyridine, 98%, Thermo Scientific Chemicals
CAS: 27911-63-3 Molecular Formula: C7H9NO Molecular Weight (g/mol): 123.15 MDL Number: MFCD04972322 InChI Key: PPHIIIRFJKDTLG-ZCFIWIBFSA-N Synonym: r-1-pyridin-2-yl ethanol,r-2-1-hydroxyethyl pyridine,r-1-2-pyridyl ethanol,1r-1-pyridin-2-yl ethan-1-ol,r-alpha-methyl-2-pyridinemethanol,1r-1-pyridin-2-ylethanol,1r-1-pyridin-2-yl ethanol,pubchem5699,r-1-pyridin-2-yl-ethanol,1r-1-2-pyridyl ethanol PubChem CID: 642847 IUPAC Name: (1R)-1-pyridin-2-ylethanol SMILES: CC(C1=CC=CC=N1)O
| PubChem CID | 642847 |
|---|---|
| CAS | 27911-63-3 |
| Molecular Weight (g/mol) | 123.15 |
| MDL Number | MFCD04972322 |
| SMILES | CC(C1=CC=CC=N1)O |
| Synonym | r-1-pyridin-2-yl ethanol,r-2-1-hydroxyethyl pyridine,r-1-2-pyridyl ethanol,1r-1-pyridin-2-yl ethan-1-ol,r-alpha-methyl-2-pyridinemethanol,1r-1-pyridin-2-ylethanol,1r-1-pyridin-2-yl ethanol,pubchem5699,r-1-pyridin-2-yl-ethanol,1r-1-2-pyridyl ethanol |
| IUPAC Name | (1R)-1-pyridin-2-ylethanol |
| InChI Key | PPHIIIRFJKDTLG-ZCFIWIBFSA-N |
| Molecular Formula | C7H9NO |
Methyl 4-formyl-1,2,5-trimethyl-1H-pyrrole-3-carboxylate, 95%, Thermo Scientific™
CAS: 175276-49-0 Molecular Formula: C10H13NO3 Molecular Weight (g/mol): 195.218 MDL Number: MFCD00203864 InChI Key: NEDLMVCFWFSFNJ-UHFFFAOYSA-N Synonym: methyl 4-formyl-1,2,5-trimethyl-1h-pyrrole-3-carboxylate,1h-pyrrole-3-carboxylicacid, 4-formyl-1,2,5-trimethyl-, methyl ester,1h-pyrrole-3-carboxylicacid,4-formyl-1,2,5-trimethyl-,methyl ester PubChem CID: 2776538 IUPAC Name: methyl 4-formyl-1,2,5-trimethylpyrrole-3-carboxylate SMILES: CC1=C(C(=C(N1C)C)C(=O)OC)C=O
| PubChem CID | 2776538 |
|---|---|
| CAS | 175276-49-0 |
| Molecular Weight (g/mol) | 195.218 |
| MDL Number | MFCD00203864 |
| SMILES | CC1=C(C(=C(N1C)C)C(=O)OC)C=O |
| Synonym | methyl 4-formyl-1,2,5-trimethyl-1h-pyrrole-3-carboxylate,1h-pyrrole-3-carboxylicacid, 4-formyl-1,2,5-trimethyl-, methyl ester,1h-pyrrole-3-carboxylicacid,4-formyl-1,2,5-trimethyl-,methyl ester |
| IUPAC Name | methyl 4-formyl-1,2,5-trimethylpyrrole-3-carboxylate |
| InChI Key | NEDLMVCFWFSFNJ-UHFFFAOYSA-N |
| Molecular Formula | C10H13NO3 |
1-(1-Benzofuran-5-yl)-2-bromo-1-ethanone, ≥97%, Thermo Scientific™
CAS: 844891-02-7 Molecular Formula: C10H7BrO2 Molecular Weight (g/mol): 239.07 MDL Number: MFCD06658969 InChI Key: KRXJQVYCIGDILC-UHFFFAOYSA-N Synonym: 1-1-benzofuran-5-yl-2-bromo-1-ethanone,1-1-benzofuran-5-yl-2-bromoethan-1-one,1-1-benzofuran-5-yl-2-bromoethanone,1-benzofuran-5-yl-2-bromoethanone,5-2-bromoacetyl benzofuran,1-benzo b furan-5-yl-2-bromoethan-1-one,1-1-benzo b furan-5-yl-2-bromo-1-ethanone PubChem CID: 2795178 IUPAC Name: 1-(1-benzofuran-5-yl)-2-bromoethanone SMILES: BrCC(=O)C1=CC=C2OC=CC2=C1
| PubChem CID | 2795178 |
|---|---|
| CAS | 844891-02-7 |
| Molecular Weight (g/mol) | 239.07 |
| MDL Number | MFCD06658969 |
| SMILES | BrCC(=O)C1=CC=C2OC=CC2=C1 |
| Synonym | 1-1-benzofuran-5-yl-2-bromo-1-ethanone,1-1-benzofuran-5-yl-2-bromoethan-1-one,1-1-benzofuran-5-yl-2-bromoethanone,1-benzofuran-5-yl-2-bromoethanone,5-2-bromoacetyl benzofuran,1-benzo b furan-5-yl-2-bromoethan-1-one,1-1-benzo b furan-5-yl-2-bromo-1-ethanone |
| IUPAC Name | 1-(1-benzofuran-5-yl)-2-bromoethanone |
| InChI Key | KRXJQVYCIGDILC-UHFFFAOYSA-N |
| Molecular Formula | C10H7BrO2 |
(4-Chlorophenyl)(4-piperidyl)methanone hydrochloride, 95%, Thermo Scientific™
CAS: 55695-51-7 Molecular Formula: C12H15ClNO Molecular Weight (g/mol): 224.71 MDL Number: MFCD00053028 InChI Key: IYGWDOXHCPQXKN-UHFFFAOYSA-O Synonym: 4-chlorophenyl piperidin-4-yl methanone hydrochloride,4-4-chlorobenzoyl piperidine hydrochloride,4-chlorophenyl 4-piperidyl methanone hydrochloride,4-chlorophenyl 4-piperidinyl methanone hydrochloride,4-p-chlorobenzoyl piperidine hydrochloride,4-4-chlorophenyl carbonyl piperidine hydrochloride,methanone, 4-chlorophenyl-4-piperidinyl-, hydrochloride,4-chlorophenyl 4-piperidinyl methanonehydrochloride,bestipharma 579-258,4-4-chlorobenzoyl piperidine hcl PubChem CID: 2777114 IUPAC Name: (4-chlorophenyl)-piperidin-4-ylmethanone;hydrochloride SMILES: ClC1=CC=C(C=C1)C(=O)C1CC[NH2+]CC1
| PubChem CID | 2777114 |
|---|---|
| CAS | 55695-51-7 |
| Molecular Weight (g/mol) | 224.71 |
| MDL Number | MFCD00053028 |
| SMILES | ClC1=CC=C(C=C1)C(=O)C1CC[NH2+]CC1 |
| Synonym | 4-chlorophenyl piperidin-4-yl methanone hydrochloride,4-4-chlorobenzoyl piperidine hydrochloride,4-chlorophenyl 4-piperidyl methanone hydrochloride,4-chlorophenyl 4-piperidinyl methanone hydrochloride,4-p-chlorobenzoyl piperidine hydrochloride,4-4-chlorophenyl carbonyl piperidine hydrochloride,methanone, 4-chlorophenyl-4-piperidinyl-, hydrochloride,4-chlorophenyl 4-piperidinyl methanonehydrochloride,bestipharma 579-258,4-4-chlorobenzoyl piperidine hcl |
| IUPAC Name | (4-chlorophenyl)-piperidin-4-ylmethanone;hydrochloride |
| InChI Key | IYGWDOXHCPQXKN-UHFFFAOYSA-O |
| Molecular Formula | C12H15ClNO |
6-(Tetrahydropyran-4-yloxy)nicotinaldehyde, 97%, Thermo Scientific™
CAS: 910036-95-2 Molecular Formula: C11H13NO3 Molecular Weight (g/mol): 207.23 MDL Number: MFCD09817493 InChI Key: ZQQOWSDTLFHTAC-UHFFFAOYSA-N Synonym: 6-tetrahydropyran-4-yloxy nicotinaldehyde,6-oxan-4-yloxy pyridine-3-carbaldehyde,6-tetrahydro-2h-pyran-4-yloxy pyridine-3-carboxaldehyde,6-tetrahydro-2h-pyran-4-yloxy nicotinaldehyde,6-tetrahydro-2h-pyran-4-yl oxy nicotinaldehyde,6-oxan-4-yl oxy pyridine-3-carbaldehyde,6-2h-3,4,5,6-tetrahydropyran-4-yloxy pyridine-3-carbaldehyde PubChem CID: 24229577 IUPAC Name: 6-(oxan-4-yloxy)pyridine-3-carbaldehyde SMILES: O=CC1=CN=C(OC2CCOCC2)C=C1
| PubChem CID | 24229577 |
|---|---|
| CAS | 910036-95-2 |
| Molecular Weight (g/mol) | 207.23 |
| MDL Number | MFCD09817493 |
| SMILES | O=CC1=CN=C(OC2CCOCC2)C=C1 |
| Synonym | 6-tetrahydropyran-4-yloxy nicotinaldehyde,6-oxan-4-yloxy pyridine-3-carbaldehyde,6-tetrahydro-2h-pyran-4-yloxy pyridine-3-carboxaldehyde,6-tetrahydro-2h-pyran-4-yloxy nicotinaldehyde,6-tetrahydro-2h-pyran-4-yl oxy nicotinaldehyde,6-oxan-4-yl oxy pyridine-3-carbaldehyde,6-2h-3,4,5,6-tetrahydropyran-4-yloxy pyridine-3-carbaldehyde |
| IUPAC Name | 6-(oxan-4-yloxy)pyridine-3-carbaldehyde |
| InChI Key | ZQQOWSDTLFHTAC-UHFFFAOYSA-N |
| Molecular Formula | C11H13NO3 |
2-Morpholinoisonicotinaldehyde, 97%, Thermo Scientific™
CAS: 864068-87-1 Molecular Formula: C10H12N2O2 Molecular Weight (g/mol): 192.22 MDL Number: MFCD08060524 InChI Key: VMFCHBZYIHUMQE-UHFFFAOYSA-N PubChem CID: 7537563 SMILES: O=CC1=CC(=NC=C1)N1CCOCC1
| PubChem CID | 7537563 |
|---|---|
| CAS | 864068-87-1 |
| Molecular Weight (g/mol) | 192.22 |
| MDL Number | MFCD08060524 |
| SMILES | O=CC1=CC(=NC=C1)N1CCOCC1 |
| InChI Key | VMFCHBZYIHUMQE-UHFFFAOYSA-N |
| Molecular Formula | C10H12N2O2 |
4-(3-Methyl-1,2,4-oxadiazol-5-yl)benzaldehyde, 90%, Thermo Scientific™
CAS: 876316-27-7 Molecular Formula: C10H8N2O2 Molecular Weight (g/mol): 188.186 MDL Number: MFCD09025865 InChI Key: AEMXYVCSLPLJOW-UHFFFAOYSA-N Synonym: 4-3-methyl-1,2,4-oxadiazol-5-yl benzaldehyde,3-methyl-5-4-formylphenyl-1,2,4-oxadiazole,benzaldehyde,4-3-methyl-1,2,4-oxadiazol-5-yl PubChem CID: 18525855 IUPAC Name: 4-(3-methyl-1,2,4-oxadiazol-5-yl)benzaldehyde SMILES: CC1=NOC(=N1)C2=CC=C(C=C2)C=O
| PubChem CID | 18525855 |
|---|---|
| CAS | 876316-27-7 |
| Molecular Weight (g/mol) | 188.186 |
| MDL Number | MFCD09025865 |
| SMILES | CC1=NOC(=N1)C2=CC=C(C=C2)C=O |
| Synonym | 4-3-methyl-1,2,4-oxadiazol-5-yl benzaldehyde,3-methyl-5-4-formylphenyl-1,2,4-oxadiazole,benzaldehyde,4-3-methyl-1,2,4-oxadiazol-5-yl |
| IUPAC Name | 4-(3-methyl-1,2,4-oxadiazol-5-yl)benzaldehyde |
| InChI Key | AEMXYVCSLPLJOW-UHFFFAOYSA-N |
| Molecular Formula | C10H8N2O2 |
(1-methyl-5-phenyl-1h-pyrazol-3-yl)methanol, 97%, Thermo Scientific™
CAS: 124344-98-5 Molecular Formula: C11H12N2O Molecular Weight (g/mol): 188.23 MDL Number: MFCD08271936 InChI Key: ZMDMCKKOZJKHKG-UHFFFAOYSA-N Synonym: 1-methyl-5-phenyl-1h-pyrazol-3-yl methanol,1-methyl-5-phenylpyrazol-3-yl methanol,1h-pyrazole-3-methanol,1-methyl-5-phenyl,3-hydroxymethyl-1-methyl-5-phenylpyrazole,acmc-20mqzk,1-methyl-5-phenylpyrazol-3-yl methan-1-ol PubChem CID: 14354447 IUPAC Name: (1-methyl-5-phenylpyrazol-3-yl)methanol SMILES: CN1C(=CC(=N1)CO)C2=CC=CC=C2
| PubChem CID | 14354447 |
|---|---|
| CAS | 124344-98-5 |
| Molecular Weight (g/mol) | 188.23 |
| MDL Number | MFCD08271936 |
| SMILES | CN1C(=CC(=N1)CO)C2=CC=CC=C2 |
| Synonym | 1-methyl-5-phenyl-1h-pyrazol-3-yl methanol,1-methyl-5-phenylpyrazol-3-yl methanol,1h-pyrazole-3-methanol,1-methyl-5-phenyl,3-hydroxymethyl-1-methyl-5-phenylpyrazole,acmc-20mqzk,1-methyl-5-phenylpyrazol-3-yl methan-1-ol |
| IUPAC Name | (1-methyl-5-phenylpyrazol-3-yl)methanol |
| InChI Key | ZMDMCKKOZJKHKG-UHFFFAOYSA-N |
| Molecular Formula | C11H12N2O |
2-Bromo-1-(2-pyridinyl)-1-ethanone hydrobromide, Thermo Scientific™
CAS: 17570-98-8 Molecular Formula: C7H7Br2NO Molecular Weight (g/mol): 280.947 InChI Key: BYKVUGZUYJUSKD-UHFFFAOYSA-N Synonym: 2-bromoacetyl pyridine hydrobromide,2-bromo-1-pyridin-2-yl ethanone hydrobromide,2-bromo-1-2-pyridinyl-1-ethanone hydrobromide,2-2-bromoacetyl pyridine hydrobromide,2-bromoacetylpyridine hydrobromide,2-bromo-1-pyridin-2-ylethanone hydrobromide,2-bromo-1-2-pyridinyl ethanone hydrobromide,2-bromo-1-pyridin-2-yl ethan-1-one hydrobromide,zlchem 1071,pubchem21374 PubChem CID: 2776231 IUPAC Name: 2-bromo-1-pyridin-2-ylethanone;hydrobromide SMILES: C1=CC=NC(=C1)C(=O)CBr.Br
| PubChem CID | 2776231 |
|---|---|
| CAS | 17570-98-8 |
| Molecular Weight (g/mol) | 280.947 |
| SMILES | C1=CC=NC(=C1)C(=O)CBr.Br |
| Synonym | 2-bromoacetyl pyridine hydrobromide,2-bromo-1-pyridin-2-yl ethanone hydrobromide,2-bromo-1-2-pyridinyl-1-ethanone hydrobromide,2-2-bromoacetyl pyridine hydrobromide,2-bromoacetylpyridine hydrobromide,2-bromo-1-pyridin-2-ylethanone hydrobromide,2-bromo-1-2-pyridinyl ethanone hydrobromide,2-bromo-1-pyridin-2-yl ethan-1-one hydrobromide,zlchem 1071,pubchem21374 |
| IUPAC Name | 2-bromo-1-pyridin-2-ylethanone;hydrobromide |
| InChI Key | BYKVUGZUYJUSKD-UHFFFAOYSA-N |
| Molecular Formula | C7H7Br2NO |
4-Pentenal, 96%
CAS: 2100-17-6 Molecular Formula: C5H8O Molecular Weight (g/mol): 84.12 MDL Number: MFCD00151841 InChI Key: QUMSUJWRUHPEEJ-UHFFFAOYSA-N Synonym: 4-pentenal,4-penten-1-al,acmc-1cdp8,qumsujwruhpeej-uhfffaoysa PubChem CID: 16418 IUPAC Name: pent-4-enal SMILES: C=CCCC=O
| PubChem CID | 16418 |
|---|---|
| CAS | 2100-17-6 |
| Molecular Weight (g/mol) | 84.12 |
| MDL Number | MFCD00151841 |
| SMILES | C=CCCC=O |
| Synonym | 4-pentenal,4-penten-1-al,acmc-1cdp8,qumsujwruhpeej-uhfffaoysa |
| IUPAC Name | pent-4-enal |
| InChI Key | QUMSUJWRUHPEEJ-UHFFFAOYSA-N |
| Molecular Formula | C5H8O |
| CAS | 6285-06-9 |
|---|---|
| MDL Number | MFCD00014392 |
Spectrum Chemical Manufacturing Corporation Diethylene Glycol, 97%, Spectrum™ Chemical
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CAS: 111-46-6
| CAS | 111-46-6 |
|---|
Azaperone
CAS: 1649-18-9 Molecular Formula: C19H22FN3O Molecular Weight (g/mol): 327.40 MDL Number: MFCD00866692 InChI Key: XTKDAFGWCDAMPY-UHFFFAOYSA-N Synonym: azaperone,stresnil,fluoperidol,suicalm,azaperon,azeperone,eucalmyl,sedaperone vet,azaperona,azaperonum PubChem CID: 15443 IUPAC Name: 1-(4-fluorophenyl)-4-(4-pyridin-2-ylpiperazin-1-yl)butan-1-one SMILES: FC1=CC=C(C=C1)C(=O)CCCN1CCN(CC1)C1=CC=CC=N1
| PubChem CID | 15443 |
|---|---|
| CAS | 1649-18-9 |
| Molecular Weight (g/mol) | 327.40 |
| MDL Number | MFCD00866692 |
| SMILES | FC1=CC=C(C=C1)C(=O)CCCN1CCN(CC1)C1=CC=CC=N1 |
| Synonym | azaperone,stresnil,fluoperidol,suicalm,azaperon,azeperone,eucalmyl,sedaperone vet,azaperona,azaperonum |
| IUPAC Name | 1-(4-fluorophenyl)-4-(4-pyridin-2-ylpiperazin-1-yl)butan-1-one |
| InChI Key | XTKDAFGWCDAMPY-UHFFFAOYSA-N |
| Molecular Formula | C19H22FN3O |