Organooxygen compounds
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Ytterbium(III) 2,4-pentanedionate, REacton™, 99.9% (REO)
CAS: 14284-98-1 Molecular Formula: C15H21O6Yb Molecular Weight (g/mol): 470.37 MDL Number: MFCD00013508 InChI Key: JKJCKIFLFXFUKJ-UHFFFAOYSA-N Synonym: ytterbium-2,4-pentanedionate,ytterbium acetyl acetonate PubChem CID: 14455610 IUPAC Name: (Z)-4-oxopent-2-en-2-olate;ytterbium(3+) SMILES: [Yb+3].CC(=O)[CH-]C(C)=O.CC(=O)[CH-]C(C)=O.CC(=O)[CH-]C(C)=O
| PubChem CID | 14455610 |
|---|---|
| CAS | 14284-98-1 |
| Molecular Weight (g/mol) | 470.37 |
| MDL Number | MFCD00013508 |
| SMILES | [Yb+3].CC(=O)[CH-]C(C)=O.CC(=O)[CH-]C(C)=O.CC(=O)[CH-]C(C)=O |
| Synonym | ytterbium-2,4-pentanedionate,ytterbium acetyl acetonate |
| IUPAC Name | (Z)-4-oxopent-2-en-2-olate;ytterbium(3+) |
| InChI Key | JKJCKIFLFXFUKJ-UHFFFAOYSA-N |
| Molecular Formula | C15H21O6Yb |
2,6-Dimethyl-5-heptenal, stabilized, Thermo Scientific Chemicals
CAS: 106-72-9 Molecular Formula: C9H16O Molecular Weight (g/mol): 140.226 MDL Number: MFCD00006981 InChI Key: YGFGZTXGYTUXBA-UHFFFAOYSA-N Synonym: 2,6-dimethyl-5-heptenal,melonal,5-heptenal, 2,6-dimethyl,bergamal,2,6-dimethyl-5-hepten-1-al,2,6-dimethyl-5-heptanal,2,6-dimethylhept-5-en-1-al,fema no. 2389,2,6-dimethyl-2-hepten-7-al,2,6-dimethyl-5-heptenal natural PubChem CID: 61016 IUPAC Name: 2,6-dimethylhept-5-enal SMILES: CC(CCC=C(C)C)C=O
| PubChem CID | 61016 |
|---|---|
| CAS | 106-72-9 |
| Molecular Weight (g/mol) | 140.226 |
| MDL Number | MFCD00006981 |
| SMILES | CC(CCC=C(C)C)C=O |
| Synonym | 2,6-dimethyl-5-heptenal,melonal,5-heptenal, 2,6-dimethyl,bergamal,2,6-dimethyl-5-hepten-1-al,2,6-dimethyl-5-heptanal,2,6-dimethylhept-5-en-1-al,fema no. 2389,2,6-dimethyl-2-hepten-7-al,2,6-dimethyl-5-heptenal natural |
| IUPAC Name | 2,6-dimethylhept-5-enal |
| InChI Key | YGFGZTXGYTUXBA-UHFFFAOYSA-N |
| Molecular Formula | C9H16O |
7-Benzyloxyindole, 98%
CAS: 20289-27-4 Molecular Formula: C15H13NO Molecular Weight (g/mol): 223.28 MDL Number: MFCD00037974 InChI Key: DIGZMTAFOACVBW-UHFFFAOYSA-N Synonym: 7-benzyloxyindole,7-benzyloxy-1h-indole,7-phenylmethoxy indole,1h-indole, 7-phenylmethoxy,7-phenylmethoxy-1h-indole,7-benzyloxy-1h-indol,7-benzyloxindole,7-benzyloxy indole PubChem CID: 260798 IUPAC Name: 7-phenylmethoxy-1H-indole SMILES: C(OC1=C2NC=CC2=CC=C1)C1=CC=CC=C1
| PubChem CID | 260798 |
|---|---|
| CAS | 20289-27-4 |
| Molecular Weight (g/mol) | 223.28 |
| MDL Number | MFCD00037974 |
| SMILES | C(OC1=C2NC=CC2=CC=C1)C1=CC=CC=C1 |
| Synonym | 7-benzyloxyindole,7-benzyloxy-1h-indole,7-phenylmethoxy indole,1h-indole, 7-phenylmethoxy,7-phenylmethoxy-1h-indole,7-benzyloxy-1h-indol,7-benzyloxindole,7-benzyloxy indole |
| IUPAC Name | 7-phenylmethoxy-1H-indole |
| InChI Key | DIGZMTAFOACVBW-UHFFFAOYSA-N |
| Molecular Formula | C15H13NO |
3,4-Dihydro-2H-1,5-benzodioxepin-7-amine, 98%
CAS: 175136-34-2 Molecular Formula: C9H11NO2 Molecular Weight (g/mol): 165.192 MDL Number: MFCD00218806 InChI Key: FVLCICVRAPEYNX-UHFFFAOYSA-N PubChem CID: 2775654 IUPAC Name: 3,4-dihydro-2H-1,5-benzodioxepin-7-amine SMILES: C1COC2=C(C=C(C=C2)N)OC1
| PubChem CID | 2775654 |
|---|---|
| CAS | 175136-34-2 |
| Molecular Weight (g/mol) | 165.192 |
| MDL Number | MFCD00218806 |
| SMILES | C1COC2=C(C=C(C=C2)N)OC1 |
| IUPAC Name | 3,4-dihydro-2H-1,5-benzodioxepin-7-amine |
| InChI Key | FVLCICVRAPEYNX-UHFFFAOYSA-N |
| Molecular Formula | C9H11NO2 |
2,6-Difluoro-4-hydroxybenzaldehyde, 95%
CAS: 532967-21-8 Molecular Formula: C7H4F2O2 Molecular Weight (g/mol): 158.104 MDL Number: MFCD07772042 InChI Key: ROAQMGJHSNIROA-UHFFFAOYSA-N Synonym: 2,6-difluoro-4-hydroxy-benzaldehyde,benzaldehyde, 2,6-difluoro-4-hydroxy,ksc495q9f,3,5-difluoro-4-formylphenol,4-hydroxy-2,6-difluorobenzaldehyde,2,6-difluoro-4-hydroxy benzaldehyde,2,6-bis fluoranyl-4-oxidanyl-benzaldehyde,benzaldehyde, 2,6-difluoro-4-hydroxy-9ci PubChem CID: 24903548 IUPAC Name: 2,6-difluoro-4-hydroxybenzaldehyde SMILES: C1=C(C=C(C(=C1F)C=O)F)O
| PubChem CID | 24903548 |
|---|---|
| CAS | 532967-21-8 |
| Molecular Weight (g/mol) | 158.104 |
| MDL Number | MFCD07772042 |
| SMILES | C1=C(C=C(C(=C1F)C=O)F)O |
| Synonym | 2,6-difluoro-4-hydroxy-benzaldehyde,benzaldehyde, 2,6-difluoro-4-hydroxy,ksc495q9f,3,5-difluoro-4-formylphenol,4-hydroxy-2,6-difluorobenzaldehyde,2,6-difluoro-4-hydroxy benzaldehyde,2,6-bis fluoranyl-4-oxidanyl-benzaldehyde,benzaldehyde, 2,6-difluoro-4-hydroxy-9ci |
| IUPAC Name | 2,6-difluoro-4-hydroxybenzaldehyde |
| InChI Key | ROAQMGJHSNIROA-UHFFFAOYSA-N |
| Molecular Formula | C7H4F2O2 |
4,5-Difluorosalicylaldehyde, 98%
CAS: 199287-52-0 Molecular Formula: C7H4F2O2 Molecular Weight (g/mol): 158.10 MDL Number: MFCD08458005 InChI Key: HRLWPXGNZQEUHM-UHFFFAOYSA-N Synonym: 2-hydroxy-4,5-difluorobenzaldehyde,4,5-difluorosalicylaldehyde,4,5-difluorosalicylaldehdye,benzaldehyde, 4,5-difluoro-2-hydroxy,benzaldehyde, 4,5-difluoro-2-hydroxy-9ci,pubchem11007,4,5-difluoro-2-hydroxy-benzaldehyde,4,5-bis fluoranyl-2-oxidanyl-benzaldehyde PubChem CID: 15434553 IUPAC Name: 4,5-difluoro-2-hydroxybenzaldehyde SMILES: OC1=CC(F)=C(F)C=C1C=O
| PubChem CID | 15434553 |
|---|---|
| CAS | 199287-52-0 |
| Molecular Weight (g/mol) | 158.10 |
| MDL Number | MFCD08458005 |
| SMILES | OC1=CC(F)=C(F)C=C1C=O |
| Synonym | 2-hydroxy-4,5-difluorobenzaldehyde,4,5-difluorosalicylaldehyde,4,5-difluorosalicylaldehdye,benzaldehyde, 4,5-difluoro-2-hydroxy,benzaldehyde, 4,5-difluoro-2-hydroxy-9ci,pubchem11007,4,5-difluoro-2-hydroxy-benzaldehyde,4,5-bis fluoranyl-2-oxidanyl-benzaldehyde |
| IUPAC Name | 4,5-difluoro-2-hydroxybenzaldehyde |
| InChI Key | HRLWPXGNZQEUHM-UHFFFAOYSA-N |
| Molecular Formula | C7H4F2O2 |
6-(Cyclopropylmethoxy)pyridine-3-boronic acid pinacol ester, 97%
CAS: 947191-69-7 Molecular Formula: C15H22BNO3 Molecular Weight (g/mol): 275.155 MDL Number: MFCD07781184 InChI Key: QEQNYJUPYICBCR-UHFFFAOYSA-N Synonym: 2-cyclopropylmethoxy-5-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl pyridine,6-cyclopropylmethoxy pyridine-3-boronic acid pinacol ester,2-cyclopropylmethoxy pyridine-5-boronic acid, pinacol ester,6-cyclopropylmethoxypyridine-3-boronic acid pinacol ester,6-cyclopropylmethoxypyridine-3-yl boronic acid pinacol ester,6-cyclopropylmethoxy pyridin-3-yl boronic acid pinacol ester,2-cyclopropyl-methoxy-5-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl pyridine,2-cyclopropylmethoxy-5-4,4,5,5-tetramethyl-1,3,2 dioxaborolan-2-yl pyridine,2-cyclopropylmethoxy-5-tetramethyl-1,3,2-dioxaborolan-2-yl pyridine PubChem CID: 24208797 IUPAC Name: 2-(cyclopropylmethoxy)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine SMILES: B1(OC(C(O1)(C)C)(C)C)C2=CN=C(C=C2)OCC3CC3
| PubChem CID | 24208797 |
|---|---|
| CAS | 947191-69-7 |
| Molecular Weight (g/mol) | 275.155 |
| MDL Number | MFCD07781184 |
| SMILES | B1(OC(C(O1)(C)C)(C)C)C2=CN=C(C=C2)OCC3CC3 |
| Synonym | 2-cyclopropylmethoxy-5-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl pyridine,6-cyclopropylmethoxy pyridine-3-boronic acid pinacol ester,2-cyclopropylmethoxy pyridine-5-boronic acid, pinacol ester,6-cyclopropylmethoxypyridine-3-boronic acid pinacol ester,6-cyclopropylmethoxypyridine-3-yl boronic acid pinacol ester,6-cyclopropylmethoxy pyridin-3-yl boronic acid pinacol ester,2-cyclopropyl-methoxy-5-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl pyridine,2-cyclopropylmethoxy-5-4,4,5,5-tetramethyl-1,3,2 dioxaborolan-2-yl pyridine,2-cyclopropylmethoxy-5-tetramethyl-1,3,2-dioxaborolan-2-yl pyridine |
| IUPAC Name | 2-(cyclopropylmethoxy)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine |
| InChI Key | QEQNYJUPYICBCR-UHFFFAOYSA-N |
| Molecular Formula | C15H22BNO3 |
6-Chloropyridine-2-carboxaldehyde, 97%
CAS: 54087-03-5 Molecular Formula: C6H4ClNO Molecular Weight (g/mol): 141.554 MDL Number: MFCD09832941 InChI Key: XTRLIKXVRGWTKW-UHFFFAOYSA-N Synonym: 6-chloropicolinaldehyde,6-chloro-2-pyridinecarbaldehyde,6-chloro-pyridine-2-carbaldehyde,2-pyridinecarboxaldehyde, 6-chloro,2-chloro-6-formylpyridine,6-chloro-2-formylpyridine,2-chloropyridine-6-carboxaldehyde,6-chloro-2-pyridinecarboxaldehyde,pubchem13323,chloropyridinecarbaldehyde PubChem CID: 10796848 IUPAC Name: 6-chloropyridine-2-carbaldehyde SMILES: C1=CC(=NC(=C1)Cl)C=O
| PubChem CID | 10796848 |
|---|---|
| CAS | 54087-03-5 |
| Molecular Weight (g/mol) | 141.554 |
| MDL Number | MFCD09832941 |
| SMILES | C1=CC(=NC(=C1)Cl)C=O |
| Synonym | 6-chloropicolinaldehyde,6-chloro-2-pyridinecarbaldehyde,6-chloro-pyridine-2-carbaldehyde,2-pyridinecarboxaldehyde, 6-chloro,2-chloro-6-formylpyridine,6-chloro-2-formylpyridine,2-chloropyridine-6-carboxaldehyde,6-chloro-2-pyridinecarboxaldehyde,pubchem13323,chloropyridinecarbaldehyde |
| IUPAC Name | 6-chloropyridine-2-carbaldehyde |
| InChI Key | XTRLIKXVRGWTKW-UHFFFAOYSA-N |
| Molecular Formula | C6H4ClNO |
2,5-Dimethoxy-4-methylbenzaldehyde, 97%
CAS: 4925-88-6 Molecular Formula: C10H12O3 Molecular Weight (g/mol): 180.20 MDL Number: MFCD02253192 InChI Key: LRSRTWLEJBIAIT-UHFFFAOYSA-N Synonym: 4-methyl-2,5-dimethoxybenzaldehyde,unii-238b3l4auk,2,5-dimethoxy-4-methyl-benzaldehyde,benzaldehyde, 2,5-dimethoxy-4-methyl,2,5-dimethoxy-p-tolualdehyde,p-tolualdehyde, 2,5-dimethoxy,who-dd,2,5-dimethoxy-4-methylbenzaldehyde;,2,5-dimethoxy-4-methyl-benzaldehyde;,# PubChem CID: 602019 IUPAC Name: 2,5-dimethoxy-4-methylbenzaldehyde SMILES: COC1=CC(C)=C(OC)C=C1C=O
| PubChem CID | 602019 |
|---|---|
| CAS | 4925-88-6 |
| Molecular Weight (g/mol) | 180.20 |
| MDL Number | MFCD02253192 |
| SMILES | COC1=CC(C)=C(OC)C=C1C=O |
| Synonym | 4-methyl-2,5-dimethoxybenzaldehyde,unii-238b3l4auk,2,5-dimethoxy-4-methyl-benzaldehyde,benzaldehyde, 2,5-dimethoxy-4-methyl,2,5-dimethoxy-p-tolualdehyde,p-tolualdehyde, 2,5-dimethoxy,who-dd,2,5-dimethoxy-4-methylbenzaldehyde;,2,5-dimethoxy-4-methyl-benzaldehyde;,# |
| IUPAC Name | 2,5-dimethoxy-4-methylbenzaldehyde |
| InChI Key | LRSRTWLEJBIAIT-UHFFFAOYSA-N |
| Molecular Formula | C10H12O3 |
3-Methylindole-2-carboxaldehyde, 97%
CAS: 5257-24-9 Molecular Formula: C10H9NO Molecular Weight (g/mol): 159.19 MDL Number: MFCD00957066 InChI Key: GHSUORIVDBPKKQ-UHFFFAOYSA-N Synonym: 3-methylindole-2-carbaldehyde,3-methyl-1h-indole-2-carboxaldehyde,3-methylindole-2-carboxaldehyde,1h-indole-2-carboxaldehyde, 3-methyl,methylindolaldehyd,3-methyl-2-indolecarbaldehyde,3-methyl-indole-2-carbaldehyde,2-formyl-3-methylindole,3-methyl-2-hydroxymethylenindol,3-methyl-1h-indole-2-carbaldehyd PubChem CID: 277260 IUPAC Name: 3-methyl-1H-indole-2-carbaldehyde SMILES: CC1=C(NC2=CC=CC=C12)C=O
| PubChem CID | 277260 |
|---|---|
| CAS | 5257-24-9 |
| Molecular Weight (g/mol) | 159.19 |
| MDL Number | MFCD00957066 |
| SMILES | CC1=C(NC2=CC=CC=C12)C=O |
| Synonym | 3-methylindole-2-carbaldehyde,3-methyl-1h-indole-2-carboxaldehyde,3-methylindole-2-carboxaldehyde,1h-indole-2-carboxaldehyde, 3-methyl,methylindolaldehyd,3-methyl-2-indolecarbaldehyde,3-methyl-indole-2-carbaldehyde,2-formyl-3-methylindole,3-methyl-2-hydroxymethylenindol,3-methyl-1h-indole-2-carbaldehyd |
| IUPAC Name | 3-methyl-1H-indole-2-carbaldehyde |
| InChI Key | GHSUORIVDBPKKQ-UHFFFAOYSA-N |
| Molecular Formula | C10H9NO |
Triethyl orthoacetate, 97%
CAS: 78-39-7 Molecular Formula: C8H18O3 Molecular Weight (g/mol): 162.229 MDL Number: MFCD00009223 InChI Key: NDQXKKFRNOPRDW-UHFFFAOYSA-N Synonym: triethyl orthoacetate,ethyl orthoacetate,ethane, 1,1,1-triethoxy,orthoacetic acid, triethyl ester,orthoacetic acid triethyl ester,triethoxyethane,triethoxy ethane,triethy orthoacetate,triethyl ortho-aceate,1,1-triethoxyethane PubChem CID: 66221 IUPAC Name: 1,1,1-triethoxyethane SMILES: CCOC(C)(OCC)OCC
| PubChem CID | 66221 |
|---|---|
| CAS | 78-39-7 |
| Molecular Weight (g/mol) | 162.229 |
| MDL Number | MFCD00009223 |
| SMILES | CCOC(C)(OCC)OCC |
| Synonym | triethyl orthoacetate,ethyl orthoacetate,ethane, 1,1,1-triethoxy,orthoacetic acid, triethyl ester,orthoacetic acid triethyl ester,triethoxyethane,triethoxy ethane,triethy orthoacetate,triethyl ortho-aceate,1,1-triethoxyethane |
| IUPAC Name | 1,1,1-triethoxyethane |
| InChI Key | NDQXKKFRNOPRDW-UHFFFAOYSA-N |
| Molecular Formula | C8H18O3 |
1,3-Cyclohexanediol, 98%, mixture of cis and trans
CAS: 504-01-8 Molecular Formula: C6H12O2 Molecular Weight (g/mol): 116.16 MDL Number: MFCD00039458 InChI Key: RLMGYIOTPQVQJR-UHFFFAOYSA-N Synonym: 1,3-cyclohexanediol,resorcitol,1,3-dihydroxycyclohexane,1,3-benzenediol, hexahydro,cis-1,3-cyclohexandiol,trans-1,3-cyclohexanediol,trans-1,3-cyclohexanol,1,3-cyclohexanediol,c&t,acmc-209ll9,acmc-209po7 PubChem CID: 10433 IUPAC Name: cyclohexane-1,3-diol SMILES: C1CC(CC(C1)O)O
| PubChem CID | 10433 |
|---|---|
| CAS | 504-01-8 |
| Molecular Weight (g/mol) | 116.16 |
| MDL Number | MFCD00039458 |
| SMILES | C1CC(CC(C1)O)O |
| Synonym | 1,3-cyclohexanediol,resorcitol,1,3-dihydroxycyclohexane,1,3-benzenediol, hexahydro,cis-1,3-cyclohexandiol,trans-1,3-cyclohexanediol,trans-1,3-cyclohexanol,1,3-cyclohexanediol,c&t,acmc-209ll9,acmc-209po7 |
| IUPAC Name | cyclohexane-1,3-diol |
| InChI Key | RLMGYIOTPQVQJR-UHFFFAOYSA-N |
| Molecular Formula | C6H12O2 |
4-Iodo-2-methoxypyridine-3-carboxaldehyde, 95%, Thermo Scientific Chemicals
CAS: 158669-26-2 Molecular Formula: C7H6INO2 Molecular Weight (g/mol): 263.03 MDL Number: MFCD05662396 InChI Key: GNBKAOHTTIVAMT-UHFFFAOYSA-N Synonym: 4-iodo-2-methoxynicotinaldehyde,4-iodo-2-methoxypyridine-3-carboxaldehyde,3-formyl-4-iodo-2-methoxypyridine,4-iodo-2-methoxy-pyridine-3-carbaldehyde,3-pyridinecarboxaldehyde, 4-iodo-2-methoxy,2-methoxy-4-iodo-3-pyridinecarboxyaldehyde,pubchem19522,iodomethoxynicotinaldehyde,2-methoxy-4-iodopyridine-3-carbaldehyde,4-iodo-2-methoxy-3-pyridinecarboxaldehyde PubChem CID: 10038381 IUPAC Name: 4-iodo-2-methoxypyridine-3-carbaldehyde SMILES: COC1=NC=CC(I)=C1C=O
| PubChem CID | 10038381 |
|---|---|
| CAS | 158669-26-2 |
| Molecular Weight (g/mol) | 263.03 |
| MDL Number | MFCD05662396 |
| SMILES | COC1=NC=CC(I)=C1C=O |
| Synonym | 4-iodo-2-methoxynicotinaldehyde,4-iodo-2-methoxypyridine-3-carboxaldehyde,3-formyl-4-iodo-2-methoxypyridine,4-iodo-2-methoxy-pyridine-3-carbaldehyde,3-pyridinecarboxaldehyde, 4-iodo-2-methoxy,2-methoxy-4-iodo-3-pyridinecarboxyaldehyde,pubchem19522,iodomethoxynicotinaldehyde,2-methoxy-4-iodopyridine-3-carbaldehyde,4-iodo-2-methoxy-3-pyridinecarboxaldehyde |
| IUPAC Name | 4-iodo-2-methoxypyridine-3-carbaldehyde |
| InChI Key | GNBKAOHTTIVAMT-UHFFFAOYSA-N |
| Molecular Formula | C7H6INO2 |
Methyl 2-hydroxyisobutyrate, 99%
CAS: 2110-78-3 Molecular Formula: C5H10O3 Molecular Weight (g/mol): 118.13 MDL Number: MFCD00004457 InChI Key: XYVQFUJDGOBPQI-UHFFFAOYSA-N Synonym: methyl 2-hydroxyisobutyrate,methyl 2-methyllactate,2-hydroxyisobutyric acid methyl ester,methyl 2-hydroxy-2-methylpropionate,methyl2-hydroxyisobutyrate,propanoic acid, 2-hydroxy-2-methyl-, methyl ester,methyl alpha-hydroxyisobutyrate,methyl .alpha.-hydroxyisobutyrate,methyl ester of 2-methyllactic acid,methyl 2-hydroxy-2-methyl-propanoate PubChem CID: 75024 IUPAC Name: methyl 2-hydroxy-2-methylpropanoate SMILES: CC(C)(C(=O)OC)O
| PubChem CID | 75024 |
|---|---|
| CAS | 2110-78-3 |
| Molecular Weight (g/mol) | 118.13 |
| MDL Number | MFCD00004457 |
| SMILES | CC(C)(C(=O)OC)O |
| Synonym | methyl 2-hydroxyisobutyrate,methyl 2-methyllactate,2-hydroxyisobutyric acid methyl ester,methyl 2-hydroxy-2-methylpropionate,methyl2-hydroxyisobutyrate,propanoic acid, 2-hydroxy-2-methyl-, methyl ester,methyl alpha-hydroxyisobutyrate,methyl .alpha.-hydroxyisobutyrate,methyl ester of 2-methyllactic acid,methyl 2-hydroxy-2-methyl-propanoate |
| IUPAC Name | methyl 2-hydroxy-2-methylpropanoate |
| InChI Key | XYVQFUJDGOBPQI-UHFFFAOYSA-N |
| Molecular Formula | C5H10O3 |
Ethyl butyrylacetate, 98%
CAS: 3249-68-1 Molecular Formula: C8H14O3 Molecular Weight (g/mol): 158.20 MDL Number: MFCD00009401 InChI Key: KQWWVLVLVYYYDT-UHFFFAOYSA-N Synonym: ethyl butyrylacetate,ethyl butyroacetate,hexanoic acid, 3-oxo-, ethyl ester,ethyl beta-ketohexanoate,ethyl alpha-butyrylacetate,3-ketohexanoic acid ethyl ester,ethyl-3-oxohexanoate,unii-8q1ahg710e,ethyl .alpha.-butyrylacetate,fema no. 3683 PubChem CID: 238498 ChEBI: CHEBI:18119 IUPAC Name: ethyl 3-oxohexanoate SMILES: CCCC(=O)CC(=O)OCC
| PubChem CID | 238498 |
|---|---|
| CAS | 3249-68-1 |
| Molecular Weight (g/mol) | 158.20 |
| ChEBI | CHEBI:18119 |
| MDL Number | MFCD00009401 |
| SMILES | CCCC(=O)CC(=O)OCC |
| Synonym | ethyl butyrylacetate,ethyl butyroacetate,hexanoic acid, 3-oxo-, ethyl ester,ethyl beta-ketohexanoate,ethyl alpha-butyrylacetate,3-ketohexanoic acid ethyl ester,ethyl-3-oxohexanoate,unii-8q1ahg710e,ethyl .alpha.-butyrylacetate,fema no. 3683 |
| IUPAC Name | ethyl 3-oxohexanoate |
| InChI Key | KQWWVLVLVYYYDT-UHFFFAOYSA-N |
| Molecular Formula | C8H14O3 |