Vinylogous acids

Organic compounds that contain one or more hydroxyl groups indirectly attached to a carbonyl group via an intervening vinyl functional group (-C=C-; also known as carbon - carbon double bond).

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4-Aminoantipyrine, 98%

CAS: 83-07-8 Molecular Formula: C₁₁H₁₃N₃O Molecular Weight (g/mol): 203.25 MDL Number: MFCD00003145 InChI Key: RLFWWDJHLFCNIJ-UHFFFAOYSA-N Synonym: 4-aminoantipyrine,ampyrone,metapirazone,aminoantipyrine,solvapyrin-a,aminoazophene,4-aminophenazone,4-aminoantipyrene,aminoantipyrin,solnapyrin-a PubChem CID: 2151 ChEBI: CHEBI:59026 IUPAC Name: 4-amino-1,5-dimethyl-2-phenylpyrazol-3-one SMILES: CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N

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PubChem CID	2151
CAS	83-07-8
Molecular Weight (g/mol)	203.25
ChEBI	CHEBI:59026
MDL Number	MFCD00003145
SMILES	CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N
Synonym	4-aminoantipyrine,ampyrone,metapirazone,aminoantipyrine,solvapyrin-a,aminoazophene,4-aminophenazone,4-aminoantipyrene,aminoantipyrin,solnapyrin-a
IUPAC Name	4-amino-1,5-dimethyl-2-phenylpyrazol-3-one
InChI Key	RLFWWDJHLFCNIJ-UHFFFAOYSA-N
Molecular Formula	C₁₁H₁₃N₃O

4-Aminoantipyrine, 97%

CAS: 83-07-8 Molecular Formula: C11H13N3O Molecular Weight (g/mol): 203.245 MDL Number: MFCD00003145 InChI Key: RLFWWDJHLFCNIJ-UHFFFAOYSA-N Synonym: 4-aminoantipyrine,ampyrone,metapirazone,aminoantipyrine,solvapyrin-a,aminoazophene,4-aminophenazone,4-aminoantipyrene,aminoantipyrin,solnapyrin-a PubChem CID: 2151 ChEBI: CHEBI:59026 IUPAC Name: 4-amino-1,5-dimethyl-2-phenylpyrazol-3-one SMILES: CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N

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PubChem CID	2151
CAS	83-07-8
Molecular Weight (g/mol)	203.245
ChEBI	CHEBI:59026
MDL Number	MFCD00003145
SMILES	CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N
Synonym	4-aminoantipyrine,ampyrone,metapirazone,aminoantipyrine,solvapyrin-a,aminoazophene,4-aminophenazone,4-aminoantipyrene,aminoantipyrin,solnapyrin-a
IUPAC Name	4-amino-1,5-dimethyl-2-phenylpyrazol-3-one
InChI Key	RLFWWDJHLFCNIJ-UHFFFAOYSA-N
Molecular Formula	C11H13N3O

3-O-Ethyl-L-ascorbic Acid 98.0+%, TCI America™

CAS: 86404-04-8 Molecular Formula: C8H12O6 Molecular Weight (g/mol): 204.178 MDL Number: MFCD09261382 InChI Key: ZGSCRDSBTNQPMS-UJURSFKZSA-N PubChem CID: 150736 IUPAC Name: (2R)-2-[(1S)-1,2-dihydroxyethyl]-3-ethoxy-4-hydroxy-2H-furan-5-one SMILES: CCOC1=C(C(=O)OC1C(CO)O)O

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PubChem CID	150736
CAS	86404-04-8
Molecular Weight (g/mol)	204.178
MDL Number	MFCD09261382
SMILES	CCOC1=C(C(=O)OC1C(CO)O)O
IUPAC Name	(2R)-2-[(1S)-1,2-dihydroxyethyl]-3-ethoxy-4-hydroxy-2H-furan-5-one
InChI Key	ZGSCRDSBTNQPMS-UJURSFKZSA-N
Molecular Formula	C8H12O6

Hypoxanthine, 99.5%

CAS: 68-94-0 Molecular Formula: C5H4N4O Molecular Weight (g/mol): 136.11 MDL Number: MFCD00005725 InChI Key: FDGQSTZJBFJUBT-UHFFFAOYSA-N Synonym: hypoxanthine,6-hydroxypurine,9h-purin-6-ol,sarkin,6-oxopurine,sarcine,sarkine,3h-purin-6-ol,7h-purin-6-ol,purin-6 1h-one PubChem CID: 790 ChEBI: CHEBI:17368 SMILES: O=C1N=CNC2=C1NC=N2

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PubChem CID	790
CAS	68-94-0
Molecular Weight (g/mol)	136.11
ChEBI	CHEBI:17368
MDL Number	MFCD00005725
SMILES	O=C1N=CNC2=C1NC=N2
Synonym	hypoxanthine,6-hydroxypurine,9h-purin-6-ol,sarkin,6-oxopurine,sarcine,sarkine,3h-purin-6-ol,7h-purin-6-ol,purin-6 1h-one
InChI Key	FDGQSTZJBFJUBT-UHFFFAOYSA-N
Molecular Formula	C5H4N4O

Mycophenolate mofetil, 98%

CAS: 128794-94-5 Molecular Formula: C₂₃H₃₁NO₇ Molecular Weight (g/mol): 433.5 InChI Key: RTGDFNSFWBGLEC-SYZQJQIISA-N Synonym: mycophenolate mofetil,cellcept,munoloc,myfenax,mycophenolic acid morpholinoethyl ester,tm-mmf,mycophenylate mofetil,mycophenolatemofetil,cellcept tn,unii-9242ecw6r0 PubChem CID: 5281078 ChEBI: CHEBI:8764 IUPAC Name: 2-morpholin-4-ylethyl (E)-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1H-2-benzofuran-5-yl)-4-methylhex-4-enoate SMILES: CC1=C(C(=C(C2=C1COC2=O)O)CC=C(C)CCC(=O)OCCN3CCOCC3)OC

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PubChem CID	5281078
CAS	128794-94-5
Molecular Weight (g/mol)	433.5
ChEBI	CHEBI:8764
SMILES	CC1=C(C(=C(C2=C1COC2=O)O)CC=C(C)CCC(=O)OCCN3CCOCC3)OC
Synonym	mycophenolate mofetil,cellcept,munoloc,myfenax,mycophenolic acid morpholinoethyl ester,tm-mmf,mycophenylate mofetil,mycophenolatemofetil,cellcept tn,unii-9242ecw6r0
IUPAC Name	2-morpholin-4-ylethyl (E)-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1H-2-benzofuran-5-yl)-4-methylhex-4-enoate
InChI Key	RTGDFNSFWBGLEC-SYZQJQIISA-N
Molecular Formula	C₂₃H₃₁NO₇

Hypoxanthine Disodium Salt, MP Biomedicals

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Specifications

PubChem CID	790
CAS	68-94-0
Molecular Weight (g/mol)	136.11
ChEBI	CHEBI:17368
MDL Number	MFCD00005725
SMILES	O=C1N=CNC2=C1NC=N2
Synonym	hypoxanthine,6-hydroxypurine,9h-purin-6-ol,sarkin,6-oxopurine,sarcine,sarkine,3h-purin-6-ol,7h-purin-6-ol,purin-6 1h-one
IUPAC Name	6,7-dihydro-3H-purin-6-one
InChI Key	FDGQSTZJBFJUBT-UHFFFAOYSA-N
Molecular Formula	C5H4N4O

4-Ethoxymethylene-2-phenyloxazolin-5-one, 98+%

CAS: 15646-46-5 Molecular Formula: C12H11NO3 Molecular Weight (g/mol): 217.224 MDL Number: MFCD00003204 InChI Key: SJHPCNCNNSSLPL-NTMALXAHSA-N Synonym: oxazolone,oxazolone sensitizing agent,5 4h-oxazolone, 4-ethoxymethylene-2-phenyl,unii-78il0j7n72,4-ethoxymethylene-2-phenyl-2-oxazolin-5-one,4-ethoxymethylene-2-phenyloxazolin-5-one,4-ethoxymethylene-2-phenyl-2-oxazoline-5-one,4z-4-ethoxymethylidene-2-phenyl-1,3-oxazol-5-one,2-oxazolin-5-one, 4-ethoxymethylene-2-phenyl,4-ethoxymethylene-2-phenyloxazolone PubChem CID: 1712094 IUPAC Name: (4Z)-4-(ethoxymethylidene)-2-phenyl-1,3-oxazol-5-one SMILES: CCOC=C1C(=O)OC(=N1)C2=CC=CC=C2

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Specifications

PubChem CID	1712094
CAS	15646-46-5
Molecular Weight (g/mol)	217.224
MDL Number	MFCD00003204
SMILES	CCOC=C1C(=O)OC(=N1)C2=CC=CC=C2
Synonym	oxazolone,oxazolone sensitizing agent,5 4h-oxazolone, 4-ethoxymethylene-2-phenyl,unii-78il0j7n72,4-ethoxymethylene-2-phenyl-2-oxazolin-5-one,4-ethoxymethylene-2-phenyloxazolin-5-one,4-ethoxymethylene-2-phenyl-2-oxazoline-5-one,4z-4-ethoxymethylidene-2-phenyl-1,3-oxazol-5-one,2-oxazolin-5-one, 4-ethoxymethylene-2-phenyl,4-ethoxymethylene-2-phenyloxazolone
IUPAC Name	(4Z)-4-(ethoxymethylidene)-2-phenyl-1,3-oxazol-5-one
InChI Key	SJHPCNCNNSSLPL-NTMALXAHSA-N
Molecular Formula	C12H11NO3

4-Aminoantipyrine, 99%, MP Biomedicals™

Molecular Formula: C11H13N3O InChI Key: RLFWWDJHLFCNIJ-UHFFFAOYSA-N PubChem CID: 2151

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PubChem CID	2151
InChI Key	RLFWWDJHLFCNIJ-UHFFFAOYSA-N
Molecular Formula	C11H13N3O

3,4-Dihydroxy-3-cyclobutene-1,2-dione 98.0+%, TCI America™

CAS: 2892-51-5 Molecular Formula: C4H2O4 Molecular Weight (g/mol): 114.056 MDL Number: MFCD00001334 InChI Key: PWEBUXCTKOWPCW-UHFFFAOYSA-N Synonym: squaric acid,3,4-dihydroxy-3-cyclobutene-1,2-dione,quadratic acid,3-cyclobutene-1,2-dione, 3,4-dihydroxy,quadratsaeure,cyclobutenedione, dihydroxy,1,2-diketo-3,4-dihydroxycyclobutene,dihydroxycyclobutenedione,unii-svr9d0vodw,dihydroxycyclobut-3-ene-1,2-dione PubChem CID: 17913 ChEBI: CHEBI:52141 IUPAC Name: 3,4-dihydroxycyclobut-3-ene-1,2-dione SMILES: C1(=C(C(=O)C1=O)O)O

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PubChem CID	17913
CAS	2892-51-5
Molecular Weight (g/mol)	114.056
ChEBI	CHEBI:52141
MDL Number	MFCD00001334
SMILES	C1(=C(C(=O)C1=O)O)O
Synonym	squaric acid,3,4-dihydroxy-3-cyclobutene-1,2-dione,quadratic acid,3-cyclobutene-1,2-dione, 3,4-dihydroxy,quadratsaeure,cyclobutenedione, dihydroxy,1,2-diketo-3,4-dihydroxycyclobutene,dihydroxycyclobutenedione,unii-svr9d0vodw,dihydroxycyclobut-3-ene-1,2-dione
IUPAC Name	3,4-dihydroxycyclobut-3-ene-1,2-dione
InChI Key	PWEBUXCTKOWPCW-UHFFFAOYSA-N
Molecular Formula	C4H2O4

Ethyl 4-pyrazolecarboxylate, 98%, Thermo Scientific™

CAS: 37622-90-5 Molecular Formula: C₆H₈N₂O₂ Molecular Weight (g/mol): 140.14 MDL Number: MFCD00010844 InChI Key: KACZQOKEFKFNDB-UHFFFAOYSA-N Synonym: ethyl 4-pyrazolecarboxylate,ethyl pyrazole-4-carboxylate,1h-pyrazole-4-carboxylic acid ethyl ester,4-ethoxycarbonylpyrazole,1h-pyrazole-4-carboxylic acid, ethyl ester,4-pyrazolecarboxylic acid ethyl ester,ethyl4-pyrazolecarboxylate,zlchem 132,pubchem21939,acmc-209iug PubChem CID: 142179 IUPAC Name: ethyl 1H-pyrazole-4-carboxylate SMILES: CCOC(=O)C1=CNN=C1

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PubChem CID	142179
CAS	37622-90-5
Molecular Weight (g/mol)	140.14
MDL Number	MFCD00010844
SMILES	CCOC(=O)C1=CNN=C1
Synonym	ethyl 4-pyrazolecarboxylate,ethyl pyrazole-4-carboxylate,1h-pyrazole-4-carboxylic acid ethyl ester,4-ethoxycarbonylpyrazole,1h-pyrazole-4-carboxylic acid, ethyl ester,4-pyrazolecarboxylic acid ethyl ester,ethyl4-pyrazolecarboxylate,zlchem 132,pubchem21939,acmc-209iug
IUPAC Name	ethyl 1H-pyrazole-4-carboxylate
InChI Key	KACZQOKEFKFNDB-UHFFFAOYSA-N
Molecular Formula	C₆H₈N₂O₂

2-(Propylthio)pyridine-3-carbonyl chloride, 97%, Thermo Scientific™

CAS: 175135-24-7 Molecular Formula: C9H10ClNOS Molecular Weight (g/mol): 215.70 MDL Number: MFCD00052656 InChI Key: FTEUTJYYROCUBI-UHFFFAOYSA-N Synonym: 2-propylthio pyridine-3-carbonyl chloride,2-propylsulfanyl pyridine-3-carbonyl chloride,2-propylthio nicotinoyl chloride,2-propylthiopyridine-3-carbonyl chloride,3-pyridinecarbonylchloride, 2-propylthio,2-propylthio pyridine-3-carbonylchloride PubChem CID: 2774530 IUPAC Name: 2-propylsulfanylpyridine-3-carbonyl chloride SMILES: CCCSC1=C(C=CC=N1)C(Cl)=O

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PubChem CID	2774530
CAS	175135-24-7
Molecular Weight (g/mol)	215.70
MDL Number	MFCD00052656
SMILES	CCCSC1=C(C=CC=N1)C(Cl)=O
Synonym	2-propylthio pyridine-3-carbonyl chloride,2-propylsulfanyl pyridine-3-carbonyl chloride,2-propylthio nicotinoyl chloride,2-propylthiopyridine-3-carbonyl chloride,3-pyridinecarbonylchloride, 2-propylthio,2-propylthio pyridine-3-carbonylchloride
IUPAC Name	2-propylsulfanylpyridine-3-carbonyl chloride
InChI Key	FTEUTJYYROCUBI-UHFFFAOYSA-N
Molecular Formula	C9H10ClNOS

(+)-Griseofulvin, 97%

CAS: 126-07-8 Molecular Formula: C17H17ClO6 Molecular Weight (g/mol): 352.767 MDL Number: MFCD00082343 InChI Key: DDUHZTYCFQRHIY-RBHXEPJQSA-N Synonym: griseofulvin,+-griseofulvin,amudane,fulvicin,griseofulvina,griseofulvinum,grisactin,grisefuline,grisovin,griseofulvine PubChem CID: 441140 ChEBI: CHEBI:27779 IUPAC Name: (2S,5'R)-7-chloro-3',4,6-trimethoxy-5'-methylspiro[1-benzofuran-2,4'-cyclohex-2-ene]-1',3-dione SMILES: CC1CC(=O)C=C(C12C(=O)C3=C(O2)C(=C(C=C3OC)OC)Cl)OC

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PubChem CID	441140
CAS	126-07-8
Molecular Weight (g/mol)	352.767
ChEBI	CHEBI:27779
MDL Number	MFCD00082343
SMILES	CC1CC(=O)C=C(C12C(=O)C3=C(O2)C(=C(C=C3OC)OC)Cl)OC
Synonym	griseofulvin,+-griseofulvin,amudane,fulvicin,griseofulvina,griseofulvinum,grisactin,grisefuline,grisovin,griseofulvine
IUPAC Name	(2S,5'R)-7-chloro-3',4,6-trimethoxy-5'-methylspiro[1-benzofuran-2,4'-cyclohex-2-ene]-1',3-dione
InChI Key	DDUHZTYCFQRHIY-RBHXEPJQSA-N
Molecular Formula	C17H17ClO6

N-Methylisatoic anhydride, tech. 90%

CAS: 10328-92-4 Molecular Formula: C9H7NO3 Molecular Weight (g/mol): 177.159 MDL Number: MFCD00006815 InChI Key: KJMRWDHBVCNLTQ-UHFFFAOYSA-N Synonym: n-methylisatoic anhydride,1-methyl-1h-benzo d 1,3 oxazine-2,4-dione,n-methyl ia,1-methyl-2h-3,1-benzoxazine-2,4 1h-dione,2h-3,1-benzoxazine-2,4 1h-dione, 1-methyl,n-methyl-n-carboxyanthranilic anhydride,methyl-n-carboxyanthranilic anhydride,1-methylbenzo d 1,3-oxazine-2,4-dione,n-methyl isotoic anhydride,1-methyl-2,4-dihydro-1h-3,1-benzoxazine-2,4-dione PubChem CID: 25160 ChEBI: CHEBI:59054 IUPAC Name: 1-methyl-3,1-benzoxazine-2,4-dione SMILES: CN1C2=CC=CC=C2C(=O)OC1=O

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Specifications

PubChem CID	25160
CAS	10328-92-4
Molecular Weight (g/mol)	177.159
ChEBI	CHEBI:59054
MDL Number	MFCD00006815
SMILES	CN1C2=CC=CC=C2C(=O)OC1=O
Synonym	n-methylisatoic anhydride,1-methyl-1h-benzo d 1,3 oxazine-2,4-dione,n-methyl ia,1-methyl-2h-3,1-benzoxazine-2,4 1h-dione,2h-3,1-benzoxazine-2,4 1h-dione, 1-methyl,n-methyl-n-carboxyanthranilic anhydride,methyl-n-carboxyanthranilic anhydride,1-methylbenzo d 1,3-oxazine-2,4-dione,n-methyl isotoic anhydride,1-methyl-2,4-dihydro-1h-3,1-benzoxazine-2,4-dione
IUPAC Name	1-methyl-3,1-benzoxazine-2,4-dione
InChI Key	KJMRWDHBVCNLTQ-UHFFFAOYSA-N
Molecular Formula	C9H7NO3

1-Methyl-1H-pyrazole-4-carboxylic acid, 97%

CAS: 5952-92-1 Molecular Formula: C₅H₆N₂O₂ Molecular Weight (g/mol): 126.11 InChI Key: UPPPWUOZCSMDTR-UHFFFAOYSA-N Synonym: 1-methyl-1h-pyrazole-4-carboxylic acid,1-methyl-4-pyrazolecarboxylic acid,1h-pyrazole-4-carboxylic acid, 1-methyl,4-carboxy-1-methyl-1h-pyrazole,1-methyl-pyrazole-4-carboxylic acid,1-methylpyrazole-4-carboxylicacid,zlchem 1243,pubchem16306,pubchem20860,acmc-209me3 PubChem CID: 643160 ChEBI: CHEBI:74741 IUPAC Name: 1-methylpyrazole-4-carboxylic acid SMILES: CN1C=C(C=N1)C(=O)O

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Specifications

PubChem CID	643160
CAS	5952-92-1
Molecular Weight (g/mol)	126.11
ChEBI	CHEBI:74741
SMILES	CN1C=C(C=N1)C(=O)O
Synonym	1-methyl-1h-pyrazole-4-carboxylic acid,1-methyl-4-pyrazolecarboxylic acid,1h-pyrazole-4-carboxylic acid, 1-methyl,4-carboxy-1-methyl-1h-pyrazole,1-methyl-pyrazole-4-carboxylic acid,1-methylpyrazole-4-carboxylicacid,zlchem 1243,pubchem16306,pubchem20860,acmc-209me3
IUPAC Name	1-methylpyrazole-4-carboxylic acid
InChI Key	UPPPWUOZCSMDTR-UHFFFAOYSA-N
Molecular Formula	C₅H₆N₂O₂

Ethyl 4-bromo-3-ethoxy-2-butenoate, tech. 90%, stab. with sodium carbonate

CAS: 1116-50-3 Molecular Formula: C8H13BrO3 Molecular Weight (g/mol): 237.09 MDL Number: MFCD00051757 InChI Key: FYYMWILFRUUBCX-UHFFFAOYSA-N Synonym: ethyl 4-bromo-3-ethoxybut-2-enoate,ethyl 4-bromo-3-ethoxy-2-butenoate,ethyl 2e-4-bromo-3-ethoxybut-2-enoate,ethyl e-4-bromo-3-ethoxybut-2-enoate PubChem CID: 6376123 SMILES: CCOC(=O)C=C(CBr)OCC

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Specifications

PubChem CID	6376123
CAS	1116-50-3
Molecular Weight (g/mol)	237.09
MDL Number	MFCD00051757
SMILES	CCOC(=O)C=C(CBr)OCC
Synonym	ethyl 4-bromo-3-ethoxybut-2-enoate,ethyl 4-bromo-3-ethoxy-2-butenoate,ethyl 2e-4-bromo-3-ethoxybut-2-enoate,ethyl e-4-bromo-3-ethoxybut-2-enoate
InChI Key	FYYMWILFRUUBCX-UHFFFAOYSA-N
Molecular Formula	C8H13BrO3

Vinylogous acids

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