Vinylogous acids
Croconic acid disodium salt, 97%
CAS: 14379-00-1 Molecular Formula: C5Na2O5 Molecular Weight (g/mol): 186.03 MDL Number: MFCD00191954 InChI Key: OQXLFPHHAAAVKQ-UHFFFAOYSA-L Synonym: croconic acid disodium salt,croconic acid, disodium salt,disodium trioxocyclopent-1-ene-1,2-bis olate,sodium 3,4,5-trioxocyclopent-1-ene-1,2-bis olate,4,5-dihydroxy-4-cyclopentene-1,2,3-trione disodium salt PubChem CID: 12120285 IUPAC Name: disodium;3,4,5-trioxocyclopentene-1,2-diolate SMILES: [Na+].[Na+].[O-]C1=C([O-])C(=O)C(=O)C1=O
Benzyl 5-amino-1H-pyrazole-4-carboxylate, 98+%
CAS: 32016-28-7 Molecular Formula: C11H11N3O2 Molecular Weight (g/mol): 217.23 MDL Number: MFCD03426023 InChI Key: QBEUXDWEKIOSIL-UHFFFAOYSA-N Synonym: benzyl 5-aminopyrazole-4-carboxylate,benzyl 3-amino-2h-pyrazole-4-carboxylate,acmc-20alpl,phenylmethyl 5-aminopyrazole-4-carboxylate,3-amino-1h-pyrazole-4-carboxylic acid benzyl ester,1h-pyrazole-4-carboxylicacid, 3-amino-, phenylmethyl ester PubChem CID: 4360500 IUPAC Name: benzyl 5-amino-1H-pyrazole-4-carboxylate SMILES: NC1=C(C=NN1)C(=O)OCC1=CC=CC=C1
Ethyl 3-trifluoromethyl-1H-pyrazole-4-carboxylate, 97%
CAS: 155377-19-8 Molecular Formula: C7H7F3N2O2 Molecular Weight (g/mol): 208.14 MDL Number: MFCD00052083 InChI Key: VYXIHSAEOXPAEY-UHFFFAOYSA-N Synonym: ethyl 3-trifluoromethyl pyrazole-4-carboxylate,ethyl 3-trifluoromethyl-1h-pyrazole-4-carboxylate,ethyl 5-trifluoromethyl-1h-pyrazole-4-carboxylate,3-trifluoromethyl-1h-pyrazole-4-carboxylic acid ethyl ester,3-trifluoromethyl pyrazole-4-carboxylic acid ethyl ester,ethyl 3-trifluoromethyl-2h-pyrazole-4-carboxylate,5-trifluoromethyl-1h-pyrazole-4-carboxylic acid ethyl ester,1h-pyrazole-4-carboxylic acid, 3-trifluoromethyl-, ethyl ester PubChem CID: 596095 IUPAC Name: ethyl 5-(trifluoromethyl)-1H-pyrazole-4-carboxylate SMILES: CCOC(=O)C1=C(NN=C1)C(F)(F)F
Ethyl 3-amino-1H-pyrazole-4-carboxylate, 99%
CAS: 6994-25-8 Molecular Formula: C6H9N3O2 Molecular Weight (g/mol): 155.157 MDL Number: MFCD00005238 InChI Key: YPXGHKWOJXQLQU-UHFFFAOYSA-N Synonym: ethyl 3-amino-1h-pyrazole-4-carboxylate,ethyl 3-amino-4-pyrazolecarboxylate,3-amino-4-carbethoxypyrazole,5-amino-1h-pyrazole-4-carboxylic acid ethyl ester,3-amino-1h-pyrazole-4-carboxylic acid ethyl ester,ethyl 3-aminopyrazole-4-carboxylate,3-amino-4-ethoxycarbonylpyrazole,unii-9gy5ha1gaa,3-amino-4-carbethoxypyrazol,1h-pyrazole-4-carboxylic acid, 3-amino-, ethyl ester PubChem CID: 81472 IUPAC Name: ethyl 5-amino-1H-pyrazole-4-carboxylate SMILES: CCOC(=O)C1=C(NN=C1)N
4-Hydroxy-3,6-dimethyl-2-pyrone, 97%
CAS: 5192-62-1 Molecular Formula: C7H8O3 Molecular Weight (g/mol): 140.138 MDL Number: MFCD00090424 InChI Key: VVBIGJOVPZMWGU-UHFFFAOYSA-N Synonym: 4-hydroxy-3,6-dimethyl-2h-pyran-2-one,3,6-dimethyl-4-hydroxy-2-pyrone,chembl51918,2h-pyran-2-one, 4-hydroxy-3,6-dimethyl,2-hydroxy-3,6-dimethylpyran-4-one,hdmpo,2-hydroxy-3,6-dimethyl-4h-pyran-4-one,acmc-20amh7,methyl triacetic lactone,4-hydroxy-3,6-dimethyl-2-pyrone PubChem CID: 54690337 IUPAC Name: 4-hydroxy-3,6-dimethylpyran-2-one SMILES: CC1=CC(=C(C(=O)O1)C)O
Methyl 4,5-dibromo-3-hydroxythiophene-2-carboxylate, 97%, Thermo Scientific™
CAS: 96232-71-2 Molecular Formula: C6H4Br2O3S Molecular Weight (g/mol): 315.96 MDL Number: MFCD00052082 InChI Key: YZPNGCXFJCPJSV-XQRVVYSFSA-N Synonym: methyl4,5-dibromo-3-hydroxythiophene-2-carboxylate,4,5-dibromo-3-hydroxythiophene-2-carboxylic acid methyl ester,2z-4,5-dibromo-2-hydroxy methoxy methylidene thiophen-3-one,acmc-20akgp,maybridge1_003706,methyl 4,5-dibromo-3-hydroxy-2-thiophenecarboxylate,4,5-dibromo-2-hydroxy methoxy methylidene thiophen-3-one,methyl 4,5-dibromo-3-hydroxythiophene-2-carboxylat,2-thiophenecarboxylicacid,4,5-dibromo-3-hydroxy-,methyl ester,2e-4,5-dibromo-2-hydroxy methoxy methylidene thiophen-3-one PubChem CID: 2777613 IUPAC Name: methyl 4,5-dibromo-3-hydroxythiophene-2-carboxylate SMILES: CO\C(O)=C1/SC(Br)=C(Br)C1=O
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
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
3,4-Dihydroxy-3-cyclobutene-1,2-dione, 99%
CAS: 2892-51-5 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
5-Hydroxy-4H-chromen-4-one, 95%, Thermo Scientific™
CAS: 3952-69-0 Molecular Formula: C9H6O3 Molecular Weight (g/mol): 162.144 MDL Number: MFCD00100605 InChI Key: CJMXMDVAKVSKFI-UHFFFAOYSA-N Synonym: 5-hydroxy-4h-chromen-4-one,5-hydroxychromone,5-hydroxy-4h-1-benzopyran-4-one,5-hydroxy-chromen-4-one,4h-1-benzopyran-4-one,5-hydroxy PubChem CID: 5479462 IUPAC Name: 5-hydroxychromen-4-one SMILES: C1=CC2=C(C(=O)C=CO2)C(=C1)O
Methyl 2-oxoindoline-7-carboxylate, 96%, Thermo Scientific Chemicals
CAS: 380427-39-4 Molecular Formula: C10H9NO3 Molecular Weight (g/mol): 191.186 MDL Number: MFCD02179610 InChI Key: XVJRNLIMSQFUAI-UHFFFAOYSA-N Synonym: methyl 2-oxoindoline-7-carboxylate,methyl oxindole-7-carboxylate,methyl 2-oxo-2,3-dihydro-1h-indole-7-carboxylate,1h-indole-7-carboxylic acid, 2,3-dihydro-2-oxo-, methyl ester,acmc-1aje4,methyl oxindole-7-carboxylate,,methyl 2-oxindole-7-carboxylate,2-oxyindole-7-carboxylic acid methyl ester,1h-indole-7-carboxylicacid, 2,3-dihydro-2-oxo-, methyl ester PubChem CID: 2773518 IUPAC Name: methyl 2-oxo-1,3-dihydroindole-7-carboxylate SMILES: COC(=O)C1=C2C(=CC=C1)CC(=O)N2
7-Deazahypoxanthine, 97%
CAS: 3680-71-5 Molecular Formula: C6H5N3O Molecular Weight (g/mol): 135.13 MDL Number: MFCD08445809 InChI Key: FBMZEITWVNHWJW-UHFFFAOYSA-N Synonym: 7h-pyrrolo 2,3-d pyrimidin-4-ol,pyrrolo 2,3-d pyrimidin-4-ol,7-deazahypoxanthine,3h-pyrrolo 2,3-d pyrimidin-4 7h-one,4-hydroxypyrrolo 2,3-d pyrimidine,4-hydroxypyrrolopyrimidine,1h-pyrrolo 2,3-d pyrimidin-4 7h-one,3,7-dihydro-4h-pyrrolo 2,3-d pyrimidin-4-one,pyrrolo 2,3-d pyrimidin-4-one PubChem CID: 96194 IUPAC Name: 1,7-dihydropyrrolo[2,3-d]pyrimidin-4-one SMILES: O=C1N=CNC2=C1C=CN2
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
Khellin, MP Biomedicals
CAS: 82-02-0 Molecular Formula: C14H12O5 Molecular Weight (g/mol): 260.245 InChI Key: HSMPDPBYAYSOBC-UHFFFAOYSA-N Synonym: khellin,visammin,amicardine,methafrone,coronin,amikellin,ammipuran,ammivisnagen,benecardin,corafurone PubChem CID: 3828 ChEBI: CHEBI:6133 IUPAC Name: 4,9-dimethoxy-7-methylfuro[3,2-g]chromen-5-one SMILES: CC1=CC(=O)C2=C(C3=C(C(=C2O1)OC)OC=C3)OC