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

Hypoxanthine Disodium Salt, MP Biomedicals

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 IUPAC Name: 6,7-dihydro-3H-purin-6-one 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
IUPAC Name	6,7-dihydro-3H-purin-6-one
InChI Key	FDGQSTZJBFJUBT-UHFFFAOYSA-N
Molecular Formula	C5H4N4O

Croconic acid, 98%

CAS: 488-86-8 Molecular Formula: C₅H₂O₅ Molecular Weight (g/mol): 142.066 MDL Number: MFCD00181389 InChI Key: RBSLJAJQOVYTRQ-UHFFFAOYSA-N Synonym: croconic acid,crocic acid,4,5-dihydroxy-4-cyclopentene-1,2,3-trione,unii-6hgy35uxaa,6hgy35uxaa,4-cyclopentene-1,2,3-trione, 4,5-dihydroxy,croconicacid,4,5-dihydroxy-4-cyclopentene-1,2,3-trione # PubChem CID: 546874 IUPAC Name: 4,5-dihydroxycyclopent-4-ene-1,2,3-trione SMILES: C1(=C(C(=O)C(=O)C1=O)O)O

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PubChem CID	546874
CAS	488-86-8
Molecular Weight (g/mol)	142.066
MDL Number	MFCD00181389
SMILES	C1(=C(C(=O)C(=O)C1=O)O)O
Synonym	croconic acid,crocic acid,4,5-dihydroxy-4-cyclopentene-1,2,3-trione,unii-6hgy35uxaa,6hgy35uxaa,4-cyclopentene-1,2,3-trione, 4,5-dihydroxy,croconicacid,4,5-dihydroxy-4-cyclopentene-1,2,3-trione #
IUPAC Name	4,5-dihydroxycyclopent-4-ene-1,2,3-trione
InChI Key	RBSLJAJQOVYTRQ-UHFFFAOYSA-N
Molecular Formula	C₅H₂O₅

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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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

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	3,7-dihydropurin-6-one
InChI Key	FDGQSTZJBFJUBT-UHFFFAOYSA-N
Molecular Formula	C5H4N4O

4-Hydroxy-6-methyl-2-pyrone, 98%

CAS: 675-10-5 Molecular Formula: C6H6O3 Molecular Weight (g/mol): 126.11 MDL Number: MFCD00006641,MFCD18820248 InChI Key: OOKCZXGEYPSNIM-UHFFFAOYSA-N Synonym: 4-hydroxy-6-methyl-2-pyrone,2-hydroxy-6-methyl-4h-pyran-4-one,4-hydroxy-6-methyl-2h-pyran-2-one,triacetic acid lactone,triacetate lactone,2h-pyran-2-one, 4-hydroxy-6-methyl,6-methyl-4-hydroxypyron-2,unii-s1s883s4ee,6-methyl-4-hydroxy-2-pyrone,ccris 3600 PubChem CID: 54675757 ChEBI: CHEBI:16458 IUPAC Name: 4-hydroxy-6-methylpyran-2-one SMILES: CC1=CC(=O)C=C(O)O1

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Specifications

PubChem CID	54675757
CAS	675-10-5
Molecular Weight (g/mol)	126.11
ChEBI	CHEBI:16458
MDL Number	MFCD00006641,MFCD18820248
SMILES	CC1=CC(=O)C=C(O)O1
Synonym	4-hydroxy-6-methyl-2-pyrone,2-hydroxy-6-methyl-4h-pyran-4-one,4-hydroxy-6-methyl-2h-pyran-2-one,triacetic acid lactone,triacetate lactone,2h-pyran-2-one, 4-hydroxy-6-methyl,6-methyl-4-hydroxypyron-2,unii-s1s883s4ee,6-methyl-4-hydroxy-2-pyrone,ccris 3600
IUPAC Name	4-hydroxy-6-methylpyran-2-one
InChI Key	OOKCZXGEYPSNIM-UHFFFAOYSA-N
Molecular Formula	C6H6O3

Isatoic anhydride, 98%

CAS: 118-48-9 Molecular Formula: C8H5NO3 Molecular Weight (g/mol): 163.13 MDL Number: MFCD00006700 InChI Key: TXJUTRJFNRYTHH-UHFFFAOYSA-N Synonym: isatoic anhydride,2h-3,1-benzoxazine-2,4 1h-dione,1h-benzo d 1,3 oxazine-2,4-dione,isatoic acid anhydride,4h-3,1-benzoxazine-2,4 1h-dione,isato acid anhydride,n-carboxyanthranilic anhydride,unii-r8tfa74y4u,3,1-benzoxazine-2,4 1h-dione,anthranilic acid, n-carboxy-, cyclic anhydride PubChem CID: 8359 SMILES: O=C1NC2=CC=CC=C2C(=O)O1

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PubChem CID	8359
CAS	118-48-9
Molecular Weight (g/mol)	163.13
MDL Number	MFCD00006700
SMILES	O=C1NC2=CC=CC=C2C(=O)O1
Synonym	isatoic anhydride,2h-3,1-benzoxazine-2,4 1h-dione,1h-benzo d 1,3 oxazine-2,4-dione,isatoic acid anhydride,4h-3,1-benzoxazine-2,4 1h-dione,isato acid anhydride,n-carboxyanthranilic anhydride,unii-r8tfa74y4u,3,1-benzoxazine-2,4 1h-dione,anthranilic acid, n-carboxy-, cyclic anhydride
InChI Key	TXJUTRJFNRYTHH-UHFFFAOYSA-N
Molecular Formula	C8H5NO3

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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Specifications

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

ethyle2-amino-5-methyl-4-phenylthiophene-3-carboxylate, 97%, Thermo Scientific™

CAS: 4815-37-6 Molecular Formula: C14H15NO2S Molecular Weight (g/mol): 261.339 MDL Number: MFCD01763475 InChI Key: SXONDAWSQJWZEO-UHFFFAOYSA-N Synonym: 2-amino-5-methyl-4-phenyl-thiophene-3-carboxylic acid ethyl ester,3-thiophenecarboxylicacid, 2-amino-5-methyl-4-phenyl-, ethyl ester,maybridge1_000503,upcmld-dp080,upcmld-dp080:001,ethyl 2-amino-5-methyl-4-phenyl-3-thiophenecarboxylate,3-thiophenecarboxylic acid,2-amino-5-methyl-4-phen,2-amino-4-phenyl-5-methylthiophene-3-carboxylic acid ethyl ester,3-thiophenecarboxylic acid, 2-amino-5-methyl-4-phenyl-, ethyl ester PubChem CID: 693902 IUPAC Name: ethyl 2-amino-5-methyl-4-phenylthiophene-3-carboxylate SMILES: CCOC(=O)C1=C(SC(=C1C2=CC=CC=C2)C)N

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PubChem CID	693902
CAS	4815-37-6
Molecular Weight (g/mol)	261.339
MDL Number	MFCD01763475
SMILES	CCOC(=O)C1=C(SC(=C1C2=CC=CC=C2)C)N
Synonym	2-amino-5-methyl-4-phenyl-thiophene-3-carboxylic acid ethyl ester,3-thiophenecarboxylicacid, 2-amino-5-methyl-4-phenyl-, ethyl ester,maybridge1_000503,upcmld-dp080,upcmld-dp080:001,ethyl 2-amino-5-methyl-4-phenyl-3-thiophenecarboxylate,3-thiophenecarboxylic acid,2-amino-5-methyl-4-phen,2-amino-4-phenyl-5-methylthiophene-3-carboxylic acid ethyl ester,3-thiophenecarboxylic acid, 2-amino-5-methyl-4-phenyl-, ethyl ester
IUPAC Name	ethyl 2-amino-5-methyl-4-phenylthiophene-3-carboxylate
InChI Key	SXONDAWSQJWZEO-UHFFFAOYSA-N
Molecular Formula	C14H15NO2S

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

2-(Ethylthio)nicotinamide, 97%, Thermo Scientific™

CAS: 175135-27-0 Molecular Formula: C8H10N2OS Molecular Weight (g/mol): 182.241 MDL Number: MFCD00052903 InChI Key: YSSWIQWINOZESS-UHFFFAOYSA-N Synonym: 2-ethylthio nicotinamide,3-pyridinecarboxamide,2-ethylthio,2-ethylsulfanyl pyridine-3-carboxamide,maybridge1_001319,2-ethylthiopyridine-3-carboxamide PubChem CID: 2774536 IUPAC Name: 2-ethylsulfanylpyridine-3-carboxamide SMILES: CCSC1=C(C=CC=N1)C(=O)N

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Specifications

PubChem CID	2774536
CAS	175135-27-0
Molecular Weight (g/mol)	182.241
MDL Number	MFCD00052903
SMILES	CCSC1=C(C=CC=N1)C(=O)N
Synonym	2-ethylthio nicotinamide,3-pyridinecarboxamide,2-ethylthio,2-ethylsulfanyl pyridine-3-carboxamide,maybridge1_001319,2-ethylthiopyridine-3-carboxamide
IUPAC Name	2-ethylsulfanylpyridine-3-carboxamide
InChI Key	YSSWIQWINOZESS-UHFFFAOYSA-N
Molecular Formula	C8H10N2OS

(+)-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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Specifications

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

Vinylogous acids

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