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Organooxygen compounds

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1,591 – 1,605 of 11,632 results
1,591

Benzyl methyl malonate, 95%

CAS: 52267-39-7 Molecular Formula: C11H12O4 Molecular Weight (g/mol): 208.21 MDL Number: MFCD00008461 InChI Key: IAUZDBFOEWAQFE-UHFFFAOYSA-N Synonym: benzyl methyl malonate,1-benzyl 3-methyl propanedioate,malonic acid 1-benzyl 3-methyl ester,propanedioic acid, methyl phenylmethyl ester,benzylmethyl malonate,methyl benzyl malonate,acmc-1b0zd,benzyl methyl propanedioate,ksc493e1f PubChem CID: 572135 IUPAC Name: 3-O-benzyl 1-O-methyl propanedioate SMILES: COC(=O)CC(=O)OCC1=CC=CC=C1

PubChem CID 572135
CAS 52267-39-7
Molecular Weight (g/mol) 208.21
MDL Number MFCD00008461
SMILES COC(=O)CC(=O)OCC1=CC=CC=C1
Synonym benzyl methyl malonate,1-benzyl 3-methyl propanedioate,malonic acid 1-benzyl 3-methyl ester,propanedioic acid, methyl phenylmethyl ester,benzylmethyl malonate,methyl benzyl malonate,acmc-1b0zd,benzyl methyl propanedioate,ksc493e1f
IUPAC Name 3-O-benzyl 1-O-methyl propanedioate
InChI Key IAUZDBFOEWAQFE-UHFFFAOYSA-N
Molecular Formula C11H12O4
1,592

4-(Trifluoromethyl)-1-indanone, 97%, Thermo Scientific Chemicals

CAS: 68755-42-0 Molecular Formula: C10H7F3O Molecular Weight (g/mol): 200.16 MDL Number: MFCD07772121 InChI Key: LJVBFMQEZSEGRL-UHFFFAOYSA-N Synonym: 4-trifluoromethyl-1-indanone,4-trifluoromethyl-2,3-dihydro-1h-inden-1-one,4-trifluoromethyl-2,3-dihydroinden-1-one,1h-inden-1-one, 2,3-dihydro-4-trifluoromethyl,4-trifluoromethyl indan-1-one,2,3-dihydro-4-trifluoromethyl-1h-inden-1-one, 2,3-dihydro-1-oxo-4-trifluoromethyl-1h-indene,acmc-1b8x3,2,3-dihydro-4-trifluoromethyl-1h-inden-1-one PubChem CID: 21921093 IUPAC Name: 4-(trifluoromethyl)-2,3-dihydroinden-1-one SMILES: C1CC(=O)C2=C1C(=CC=C2)C(F)(F)F

PubChem CID 21921093
CAS 68755-42-0
Molecular Weight (g/mol) 200.16
MDL Number MFCD07772121
SMILES C1CC(=O)C2=C1C(=CC=C2)C(F)(F)F
Synonym 4-trifluoromethyl-1-indanone,4-trifluoromethyl-2,3-dihydro-1h-inden-1-one,4-trifluoromethyl-2,3-dihydroinden-1-one,1h-inden-1-one, 2,3-dihydro-4-trifluoromethyl,4-trifluoromethyl indan-1-one,2,3-dihydro-4-trifluoromethyl-1h-inden-1-one, 2,3-dihydro-1-oxo-4-trifluoromethyl-1h-indene,acmc-1b8x3,2,3-dihydro-4-trifluoromethyl-1h-inden-1-one
IUPAC Name 4-(trifluoromethyl)-2,3-dihydroinden-1-one
InChI Key LJVBFMQEZSEGRL-UHFFFAOYSA-N
Molecular Formula C10H7F3O
1,593

5-Bromopyridine-3-carboxaldehyde, 97%

CAS: 113118-81-3 Molecular Formula: C6H4BrNO Molecular Weight (g/mol): 186.008 MDL Number: MFCD03265758 InChI Key: NGUVGKAEOFPLDT-UHFFFAOYSA-N Synonym: 5-bromonicotinaldehyde,5-bromo-3-pyridinecarboxaldehyde,5-bromo-3-formylpyridine,3-bromopyridine-5-carboxaldehyde,5-bromopyridine-3-carboxaldehyde,5-bromo-pyridine-3-carbaldehyde,3-bromo-5-formylpyridine,3-pyridinecarboxaldehyde, 5-bromo,3-bromopyridine-5-carbaldehyde,5-bromo-3-pyridinecarbaldehyde PubChem CID: 2784734 IUPAC Name: 5-bromopyridine-3-carbaldehyde SMILES: C1=C(C=NC=C1Br)C=O

PubChem CID 2784734
CAS 113118-81-3
Molecular Weight (g/mol) 186.008
MDL Number MFCD03265758
SMILES C1=C(C=NC=C1Br)C=O
Synonym 5-bromonicotinaldehyde,5-bromo-3-pyridinecarboxaldehyde,5-bromo-3-formylpyridine,3-bromopyridine-5-carboxaldehyde,5-bromopyridine-3-carboxaldehyde,5-bromo-pyridine-3-carbaldehyde,3-bromo-5-formylpyridine,3-pyridinecarboxaldehyde, 5-bromo,3-bromopyridine-5-carbaldehyde,5-bromo-3-pyridinecarbaldehyde
IUPAC Name 5-bromopyridine-3-carbaldehyde
InChI Key NGUVGKAEOFPLDT-UHFFFAOYSA-N
Molecular Formula C6H4BrNO
1,594

4-Fluoro-1-indanone, 97%

CAS: 699-99-0 Molecular Formula: C9H7FO Molecular Weight (g/mol): 150.152 MDL Number: MFCD00797829 InChI Key: HOMSJDBZHCPYHY-UHFFFAOYSA-N Synonym: 4-fluoro-1-indanone,4-fluoro-2,3-dihydro-1h-inden-1-one,4-fluoro-indan-1-one,4-fluoroindan-1-one,1h-inden-1-one, 4-fluoro-2,3-dihydro,4-fluoro-2,3-dihydro-1-indenone,4-fluoroindane-1-one,acmc-20a8cy,4-fluoranyl-2,3-dihydroinden-1-one PubChem CID: 12174986 IUPAC Name: 4-fluoro-2,3-dihydroinden-1-one SMILES: C1CC(=O)C2=C1C(=CC=C2)F

PubChem CID 12174986
CAS 699-99-0
Molecular Weight (g/mol) 150.152
MDL Number MFCD00797829
SMILES C1CC(=O)C2=C1C(=CC=C2)F
Synonym 4-fluoro-1-indanone,4-fluoro-2,3-dihydro-1h-inden-1-one,4-fluoro-indan-1-one,4-fluoroindan-1-one,1h-inden-1-one, 4-fluoro-2,3-dihydro,4-fluoro-2,3-dihydro-1-indenone,4-fluoroindane-1-one,acmc-20a8cy,4-fluoranyl-2,3-dihydroinden-1-one
IUPAC Name 4-fluoro-2,3-dihydroinden-1-one
InChI Key HOMSJDBZHCPYHY-UHFFFAOYSA-N
Molecular Formula C9H7FO
1,595

Ethyl 2-oxocyclohexanecarboxylate, 95%

CAS: 1655-07-8 Molecular Formula: C9H14O3 Molecular Weight (g/mol): 170.21 MDL Number: MFCD00001631 InChI Key: FGSGHBPKHFDJOP-UHFFFAOYNA-N Synonym: ethyl 2-oxocyclohexanecarboxylate,ethyl 2-cyclohexanonecarboxylate,2-carbethoxycyclohexanone,ethyl cyclohexanone-2-carboxylate,cyclohexanecarboxylic acid, 2-oxo-, ethyl ester,2-ethoxycarbonyl cyclohexanone,2-cyclohexanonecarboxylic acid ethyl ester,2-oxocyclohexanecarboxylic acid ethyl ester,ethyl 2-oxo-1-cyclohexanecarboxylate,ethyl 2-oxocylohexanecarboxylate PubChem CID: 95543 IUPAC Name: ethyl 2-oxocyclohexane-1-carboxylate SMILES: CCOC(=O)C1CCCCC1=O

PubChem CID 95543
CAS 1655-07-8
Molecular Weight (g/mol) 170.21
MDL Number MFCD00001631
SMILES CCOC(=O)C1CCCCC1=O
Synonym ethyl 2-oxocyclohexanecarboxylate,ethyl 2-cyclohexanonecarboxylate,2-carbethoxycyclohexanone,ethyl cyclohexanone-2-carboxylate,cyclohexanecarboxylic acid, 2-oxo-, ethyl ester,2-ethoxycarbonyl cyclohexanone,2-cyclohexanonecarboxylic acid ethyl ester,2-oxocyclohexanecarboxylic acid ethyl ester,ethyl 2-oxo-1-cyclohexanecarboxylate,ethyl 2-oxocylohexanecarboxylate
IUPAC Name ethyl 2-oxocyclohexane-1-carboxylate
InChI Key FGSGHBPKHFDJOP-UHFFFAOYNA-N
Molecular Formula C9H14O3
1,596

2,3-Dihydrobenzo[b]furan-5-carboxaldehyde, 97%

CAS: 55745-70-5 Molecular Formula: C9H8O2 Molecular Weight (g/mol): 148.16 MDL Number: MFCD00068058 InChI Key: WEBVDBDZSOJGPB-UHFFFAOYSA-N Synonym: 2,3-dihydrobenzofuran-5-carboxaldehyde,2,3-dihydrobenzo b furan-5-carbaldehyde,2,3-dihydrobenzofuran-5-carbaldehyde,2,3-dihydrobenzo b furan-5-carboxaldehyde,2,3-dihyro-1-benzofuran-5-carbaldehyde,2,3-dihydro-benzofuran-5-carbaldehyde,5-coumarancarboxaldehyde,2,3-dihydro-5-benzofurancarboxaldehyde,5-benzofurancarboxaldehyde, 2,3-dihydro,2,3-dihydro-5-benzofurancarbaldehyde PubChem CID: 735901 IUPAC Name: 2,3-dihydro-1-benzofuran-5-carbaldehyde SMILES: O=CC1=CC=C2OCCC2=C1

PubChem CID 735901
CAS 55745-70-5
Molecular Weight (g/mol) 148.16
MDL Number MFCD00068058
SMILES O=CC1=CC=C2OCCC2=C1
Synonym 2,3-dihydrobenzofuran-5-carboxaldehyde,2,3-dihydrobenzo b furan-5-carbaldehyde,2,3-dihydrobenzofuran-5-carbaldehyde,2,3-dihydrobenzo b furan-5-carboxaldehyde,2,3-dihyro-1-benzofuran-5-carbaldehyde,2,3-dihydro-benzofuran-5-carbaldehyde,5-coumarancarboxaldehyde,2,3-dihydro-5-benzofurancarboxaldehyde,5-benzofurancarboxaldehyde, 2,3-dihydro,2,3-dihydro-5-benzofurancarbaldehyde
IUPAC Name 2,3-dihydro-1-benzofuran-5-carbaldehyde
InChI Key WEBVDBDZSOJGPB-UHFFFAOYSA-N
Molecular Formula C9H8O2
1,597

2-Bromo-2',4'-dichloroacetophenone, 95%

CAS: 2631-72-3 Molecular Formula: C8H5BrCl2O Molecular Weight (g/mol): 267.931 MDL Number: MFCD00053005 InChI Key: DASJDMQCPIDJIF-UHFFFAOYSA-N Synonym: 2-bromo-2',4'-dichloroacetophenone,2-bromo-1-2,4-dichlorophenyl ethanone,2,4-dichlorophenacyl bromide,2-bromo-1-2,4-dichlorophenyl ethan-1-one,2-bromo-1-2,4-dichloro-phenyl-ethanone,ethanone, 2-bromo-1-2,4-dichlorophenyl,2'-bromo-2,4-dichloro acetophenone,omega-bromo-2,4-dichloro acetophenone,2',4'-dichlorophenacyl bromide,2-bromo-2,4-dichloroacetophenone PubChem CID: 75828 IUPAC Name: 2-bromo-1-(2,4-dichlorophenyl)ethanone SMILES: C1=CC(=C(C=C1Cl)Cl)C(=O)CBr

PubChem CID 75828
CAS 2631-72-3
Molecular Weight (g/mol) 267.931
MDL Number MFCD00053005
SMILES C1=CC(=C(C=C1Cl)Cl)C(=O)CBr
Synonym 2-bromo-2',4'-dichloroacetophenone,2-bromo-1-2,4-dichlorophenyl ethanone,2,4-dichlorophenacyl bromide,2-bromo-1-2,4-dichlorophenyl ethan-1-one,2-bromo-1-2,4-dichloro-phenyl-ethanone,ethanone, 2-bromo-1-2,4-dichlorophenyl,2'-bromo-2,4-dichloro acetophenone,omega-bromo-2,4-dichloro acetophenone,2',4'-dichlorophenacyl bromide,2-bromo-2,4-dichloroacetophenone
IUPAC Name 2-bromo-1-(2,4-dichlorophenyl)ethanone
InChI Key DASJDMQCPIDJIF-UHFFFAOYSA-N
Molecular Formula C8H5BrCl2O
1,598

2-Methyl-2-propen-1-ol, 98%

CAS: 513-42-8 Molecular Formula: C4H8O MDL Number: MFCD00004737 InChI Key: BYDRTKVGBRTTIT-UHFFFAOYSA-N PubChem CID: 10557 IUPAC Name: 2-methylprop-2-en-1-ol SMILES: CC(=C)CO

PubChem CID 10557
CAS 513-42-8
MDL Number MFCD00004737
SMILES CC(=C)CO
IUPAC Name 2-methylprop-2-en-1-ol
InChI Key BYDRTKVGBRTTIT-UHFFFAOYSA-N
Molecular Formula C4H8O
1,599

5'-Bromo-2'-fluoroacetophenone, 98%

CAS: 198477-89-3 Molecular Formula: C8H6BrFO Molecular Weight (g/mol): 217.037 MDL Number: MFCD11226880 InChI Key: XNRQIHIOKXQSPG-UHFFFAOYSA-N Synonym: 1-5-bromo-2-fluorophenyl ethanone,1-5-bromo-2-fluorophenyl-1-ethanone,1-5-bromo-2-fluorophenyl ethan-1-one,ethanone, 1-5-bromo-2-fluorophenyl,5'-bromo-2'-fluoroacetophenone,1-acetyl-5-bromo-2-fluorobenzene,1-5-bromo-2-fluoro-phenyl-ethanone,pubchem16430,acmc-1c1do,5-bromo-2-fluoroacetophenone PubChem CID: 22607476 IUPAC Name: 1-(5-bromo-2-fluorophenyl)ethanone SMILES: CC(=O)C1=C(C=CC(=C1)Br)F

PubChem CID 22607476
CAS 198477-89-3
Molecular Weight (g/mol) 217.037
MDL Number MFCD11226880
SMILES CC(=O)C1=C(C=CC(=C1)Br)F
Synonym 1-5-bromo-2-fluorophenyl ethanone,1-5-bromo-2-fluorophenyl-1-ethanone,1-5-bromo-2-fluorophenyl ethan-1-one,ethanone, 1-5-bromo-2-fluorophenyl,5'-bromo-2'-fluoroacetophenone,1-acetyl-5-bromo-2-fluorobenzene,1-5-bromo-2-fluoro-phenyl-ethanone,pubchem16430,acmc-1c1do,5-bromo-2-fluoroacetophenone
IUPAC Name 1-(5-bromo-2-fluorophenyl)ethanone
InChI Key XNRQIHIOKXQSPG-UHFFFAOYSA-N
Molecular Formula C8H6BrFO
1,600

2',4'-Difluoro-2-(1H-1,2,4-triazol-1-yl)acetophenone, 97%

CAS: 86404-63-9 Molecular Formula: C10H7F2N3O Molecular Weight (g/mol): 223.183 MDL Number: MFCD02093825 InChI Key: XCHRPVARHBCFMJ-UHFFFAOYSA-N Synonym: 1-2,4-difluorophenyl-2-1h-1,2,4-triazol-1-yl ethanone,2,4-difluoro-alpha-1h-1,2,4-triazolyl acetophenone,1-2,4-difluorophenyl-2-1,2,4-triazol-1-yl ethanone,2',4'-difluoro-2-1h-1,2,4-triazol-1-yl acetophenone,unii-hxi8r9r915,2-1h-1,2,4-triazol-1-yl-2',4'-difluoroacetophenone,ethanone, 1-2,4-difluorophenyl-2-1h-1,2,4-triazol-1-yl,2',4'-difluoro-2-1h-1,2,4-triazolyl acetophenone,1-2,4-difluorophenyl-2-1h-1,2,4-triazol-1-yl ethan-1-one,1-2,4-difluorophenyl-2-1h-1,2,4-triazol-1-yl-ethanone PubChem CID: 588080 IUPAC Name: 1-(2,4-difluorophenyl)-2-(1,2,4-triazol-1-yl)ethanone SMILES: C1=CC(=C(C=C1F)F)C(=O)CN2C=NC=N2

PubChem CID 588080
CAS 86404-63-9
Molecular Weight (g/mol) 223.183
MDL Number MFCD02093825
SMILES C1=CC(=C(C=C1F)F)C(=O)CN2C=NC=N2
Synonym 1-2,4-difluorophenyl-2-1h-1,2,4-triazol-1-yl ethanone,2,4-difluoro-alpha-1h-1,2,4-triazolyl acetophenone,1-2,4-difluorophenyl-2-1,2,4-triazol-1-yl ethanone,2',4'-difluoro-2-1h-1,2,4-triazol-1-yl acetophenone,unii-hxi8r9r915,2-1h-1,2,4-triazol-1-yl-2',4'-difluoroacetophenone,ethanone, 1-2,4-difluorophenyl-2-1h-1,2,4-triazol-1-yl,2',4'-difluoro-2-1h-1,2,4-triazolyl acetophenone,1-2,4-difluorophenyl-2-1h-1,2,4-triazol-1-yl ethan-1-one,1-2,4-difluorophenyl-2-1h-1,2,4-triazol-1-yl-ethanone
IUPAC Name 1-(2,4-difluorophenyl)-2-(1,2,4-triazol-1-yl)ethanone
InChI Key XCHRPVARHBCFMJ-UHFFFAOYSA-N
Molecular Formula C10H7F2N3O
1,601

3,5-Dimethylisoxazole-4-carboxaldehyde, 97%

CAS: 54593-26-9 Molecular Formula: C6H7NO2 Molecular Weight (g/mol): 125.127 MDL Number: MFCD02681977 InChI Key: TVAYXKLCEILMEA-UHFFFAOYSA-N Synonym: 3,5-dimethyl-4-isoxazolecarbaldehyde,3,5-dimethylisoxazole-4-carbaldehyde,3,5-dimethylisoxazole-4-carboxaldehyde,4-isoxazolecarboxaldehyde, 3,5-dimethyl,3,5-dimethyl-4-isoxazolecarboxaldehyde,3,5-dimethyl-4-formalisoxazole,pubchem8682,acmc-1axd1,ksc496e3j,3,5-dimethylisoxazol-4-carbaldehyde PubChem CID: 289576 IUPAC Name: 3,5-dimethyl-1,2-oxazole-4-carbaldehyde SMILES: CC1=C(C(=NO1)C)C=O

PubChem CID 289576
CAS 54593-26-9
Molecular Weight (g/mol) 125.127
MDL Number MFCD02681977
SMILES CC1=C(C(=NO1)C)C=O
Synonym 3,5-dimethyl-4-isoxazolecarbaldehyde,3,5-dimethylisoxazole-4-carbaldehyde,3,5-dimethylisoxazole-4-carboxaldehyde,4-isoxazolecarboxaldehyde, 3,5-dimethyl,3,5-dimethyl-4-isoxazolecarboxaldehyde,3,5-dimethyl-4-formalisoxazole,pubchem8682,acmc-1axd1,ksc496e3j,3,5-dimethylisoxazol-4-carbaldehyde
IUPAC Name 3,5-dimethyl-1,2-oxazole-4-carbaldehyde
InChI Key TVAYXKLCEILMEA-UHFFFAOYSA-N
Molecular Formula C6H7NO2
1,602

4-Hydroxymethyl-2,6,7-trioxa-1-phosphabicyclo[2.2.2]octane 1-oxide, 98%

CAS: 5301-78-0 Molecular Formula: C5H9O5P Molecular Weight (g/mol): 180.096 MDL Number: MFCD01677612 InChI Key: YASRHLDAFCMIPB-UHFFFAOYSA-N PubChem CID: 199942 IUPAC Name: (1-oxo-2,6,7-trioxa-1$l^{5}-phosphabicyclo[2.2.2]octan-4-yl)methanol SMILES: C1C2(COP(=O)(O1)OC2)CO

PubChem CID 199942
CAS 5301-78-0
Molecular Weight (g/mol) 180.096
MDL Number MFCD01677612
SMILES C1C2(COP(=O)(O1)OC2)CO
IUPAC Name (1-oxo-2,6,7-trioxa-1$l^{5}-phosphabicyclo[2.2.2]octan-4-yl)methanol
InChI Key YASRHLDAFCMIPB-UHFFFAOYSA-N
Molecular Formula C5H9O5P
1,603

1,1,3-Trimethoxypropane, 97%

CAS: 14315-97-0 Molecular Formula: C6H14O3 Molecular Weight (g/mol): 134.18 MDL Number: MFCD00008490 InChI Key: FKZYYYDRLJCHGL-UHFFFAOYSA-N Synonym: propane, 1,1,3-trimethoxy,propane,1,1,3-trimethoxy,acmc-1brb6,1,1,3-trimethoxy-propane,1,1,3-trimethoxypropane,beta-methoxypropionaldehyde dimethyl acetal PubChem CID: 84348 IUPAC Name: 1,1,3-trimethoxypropane SMILES: COCCC(OC)OC

PubChem CID 84348
CAS 14315-97-0
Molecular Weight (g/mol) 134.18
MDL Number MFCD00008490
SMILES COCCC(OC)OC
Synonym propane, 1,1,3-trimethoxy,propane,1,1,3-trimethoxy,acmc-1brb6,1,1,3-trimethoxy-propane,1,1,3-trimethoxypropane,beta-methoxypropionaldehyde dimethyl acetal
IUPAC Name 1,1,3-trimethoxypropane
InChI Key FKZYYYDRLJCHGL-UHFFFAOYSA-N
Molecular Formula C6H14O3
1,604

3,5-Di-tert-butyl-2-hydroxybenzaldehyde, 99%

CAS: 37942-07-7 Molecular Formula: C15H22O2 Molecular Weight (g/mol): 234.339 MDL Number: MFCD00191998 InChI Key: RRIQVLZDOZPJTH-UHFFFAOYSA-N Synonym: 3,5-di-tert-butyl-2-hydroxybenzaldehyde,3,5-di-tert-butylsalicylaldehyde,3,5-bis 1,1-dimethylethyl-2-hydroxy-benzaldehyde,benzaldehyde, 3,5-bis 1,1-dimethylethyl-2-hydroxy,3,5-di-t-butylsalicylaldehyde,3,5-di-tert-butyl-2-hydroxy-benzaldehyde,benzaldehyde, 2-hydroxy, 3,5-di t-butyl,3,5-bis tert-butyl-2-hydroxybenzaldehyde,pubchem11247,acmc-1aete PubChem CID: 688023 IUPAC Name: 3,5-ditert-butyl-2-hydroxybenzaldehyde SMILES: CC(C)(C)C1=CC(=C(C(=C1)C=O)O)C(C)(C)C

PubChem CID 688023
CAS 37942-07-7
Molecular Weight (g/mol) 234.339
MDL Number MFCD00191998
SMILES CC(C)(C)C1=CC(=C(C(=C1)C=O)O)C(C)(C)C
Synonym 3,5-di-tert-butyl-2-hydroxybenzaldehyde,3,5-di-tert-butylsalicylaldehyde,3,5-bis 1,1-dimethylethyl-2-hydroxy-benzaldehyde,benzaldehyde, 3,5-bis 1,1-dimethylethyl-2-hydroxy,3,5-di-t-butylsalicylaldehyde,3,5-di-tert-butyl-2-hydroxy-benzaldehyde,benzaldehyde, 2-hydroxy, 3,5-di t-butyl,3,5-bis tert-butyl-2-hydroxybenzaldehyde,pubchem11247,acmc-1aete
IUPAC Name 3,5-ditert-butyl-2-hydroxybenzaldehyde
InChI Key RRIQVLZDOZPJTH-UHFFFAOYSA-N
Molecular Formula C15H22O2
1,605

Sodium 2,4-pentanedionate hydrate, 94%

CAS: 86891-03-4 Molecular Formula: C5H7NaO2 Molecular Weight (g/mol): 122.10 MDL Number: MFCD00078034 InChI Key: AIWZOHBYSFSQGV-UHFFFAOYSA-M Synonym: sodium 2,4-pentanedionate,sodium 2e-4-oxopent-2-en-2-olate hydrate PubChem CID: 90476915 IUPAC Name: sodium;(E)-4-oxopent-2-en-2-olate;hydrate SMILES: [Na+].CC([O-])=CC(C)=O

PubChem CID 90476915
CAS 86891-03-4
Molecular Weight (g/mol) 122.10
MDL Number MFCD00078034
SMILES [Na+].CC([O-])=CC(C)=O
Synonym sodium 2,4-pentanedionate,sodium 2e-4-oxopent-2-en-2-olate hydrate
IUPAC Name sodium;(E)-4-oxopent-2-en-2-olate;hydrate
InChI Key AIWZOHBYSFSQGV-UHFFFAOYSA-M
Molecular Formula C5H7NaO2