Organoheterocyclic compounds
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Ethyl 2,4-Dihydroxy-6-methylnicotinate 98.0+%, TCI America™
CAS: 70254-52-3 Molecular Formula: C9H11NO4 Molecular Weight (g/mol): 197.19 MDL Number: MFCD02929397 InChI Key: CMCZAWPDHHYFPU-UHFFFAOYSA-N PubChem CID: 54676534 IUPAC Name: ethyl 4-hydroxy-6-methyl-2-oxo-1H-pyridine-3-carboxylate SMILES: CCOC(=O)C1=C(C=C(NC1=O)C)O
| PubChem CID | 54676534 |
|---|---|
| CAS | 70254-52-3 |
| Molecular Weight (g/mol) | 197.19 |
| MDL Number | MFCD02929397 |
| SMILES | CCOC(=O)C1=C(C=C(NC1=O)C)O |
| IUPAC Name | ethyl 4-hydroxy-6-methyl-2-oxo-1H-pyridine-3-carboxylate |
| InChI Key | CMCZAWPDHHYFPU-UHFFFAOYSA-N |
| Molecular Formula | C9H11NO4 |
6-Chloro-2,4-dimethoxypyrimidine 98.0+%, TCI America™
CAS: 6320-15-6 Molecular Formula: C6H7ClN2O2 Molecular Weight (g/mol): 174.58 MDL Number: MFCD00006068 InChI Key: JHNRTJRDRWKAIW-UHFFFAOYSA-N Synonym: 6-chloro-2,4-dimethoxypyrimidine,2,4-dimethoxy-6-chloropyrimidine,pyrimidine, 4-chloro-2,6-dimethoxy,4-chloro-2,6-dimethoxy-pyrimidine,pubchem16350,acmc-209ndu,4-chlor-2,6-dimethoxypyrimidin,4-chloro-2,6-dimethoxypyrimidin,2,6-dimethoxy-4-chloropyrimidine,6-chloro-2,4-dimethixypyrimidine PubChem CID: 80600 IUPAC Name: 4-chloro-2,6-dimethoxypyrimidine SMILES: COC1=CC(Cl)=NC(OC)=N1
| PubChem CID | 80600 |
|---|---|
| CAS | 6320-15-6 |
| Molecular Weight (g/mol) | 174.58 |
| MDL Number | MFCD00006068 |
| SMILES | COC1=CC(Cl)=NC(OC)=N1 |
| Synonym | 6-chloro-2,4-dimethoxypyrimidine,2,4-dimethoxy-6-chloropyrimidine,pyrimidine, 4-chloro-2,6-dimethoxy,4-chloro-2,6-dimethoxy-pyrimidine,pubchem16350,acmc-209ndu,4-chlor-2,6-dimethoxypyrimidin,4-chloro-2,6-dimethoxypyrimidin,2,6-dimethoxy-4-chloropyrimidine,6-chloro-2,4-dimethixypyrimidine |
| IUPAC Name | 4-chloro-2,6-dimethoxypyrimidine |
| InChI Key | JHNRTJRDRWKAIW-UHFFFAOYSA-N |
| Molecular Formula | C6H7ClN2O2 |
trans-1,2-Di(2-thienyl)ethylene 98.0+%, TCI America™
CAS: 13640-78-3 Molecular Formula: C10H8S2 Molecular Weight (g/mol): 192.294 MDL Number: MFCD00145416 InChI Key: AYBFWHPZXYPJFW-AATRIKPKSA-N PubChem CID: 5375272 IUPAC Name: 2-[(E)-2-thiophen-2-ylethenyl]thiophene SMILES: C1=CSC(=C1)C=CC2=CC=CS2
| PubChem CID | 5375272 |
|---|---|
| CAS | 13640-78-3 |
| Molecular Weight (g/mol) | 192.294 |
| MDL Number | MFCD00145416 |
| SMILES | C1=CSC(=C1)C=CC2=CC=CS2 |
| IUPAC Name | 2-[(E)-2-thiophen-2-ylethenyl]thiophene |
| InChI Key | AYBFWHPZXYPJFW-AATRIKPKSA-N |
| Molecular Formula | C10H8S2 |
4,6-Dihydroxy-5-nitropyrimidine 98.0+%, TCI America™
CAS: 2164-83-2 Molecular Formula: C4H3N3O4 Molecular Weight (g/mol): 157.09 MDL Number: MFCD00006110 InChI Key: ABTLZAVJDRUDNG-UHFFFAOYSA-N Synonym: 4,6-dihydroxy-5-nitropyrimidine,5-nitropyrimidine-4,6-diol,4,6-dihydroxy-5-nitropyrimdine,5-nitro-4,6-pyrimidinediol,4 1h-pyrimidinone, 6-hydroxy-5-nitro,6-hydroxy-5-nitro-3h-pyrimidin-4-one,6-hydroxy-5-nitro-4 1h-pyrimidinone,5-nitro-4,6-dihydroxypyrimidine,4-hydroxy-5-nitro-1h-pyrimidin-6-one,4 3h-pyrimidinone, 6-hydroxy-5-nitro PubChem CID: 75105 IUPAC Name: 6-hydroxy-5-nitro-3,4-dihydropyrimidin-4-one SMILES: OC1=C(C(=O)NC=N1)[N+]([O-])=O
| PubChem CID | 75105 |
|---|---|
| CAS | 2164-83-2 |
| Molecular Weight (g/mol) | 157.09 |
| MDL Number | MFCD00006110 |
| SMILES | OC1=C(C(=O)NC=N1)[N+]([O-])=O |
| Synonym | 4,6-dihydroxy-5-nitropyrimidine,5-nitropyrimidine-4,6-diol,4,6-dihydroxy-5-nitropyrimdine,5-nitro-4,6-pyrimidinediol,4 1h-pyrimidinone, 6-hydroxy-5-nitro,6-hydroxy-5-nitro-3h-pyrimidin-4-one,6-hydroxy-5-nitro-4 1h-pyrimidinone,5-nitro-4,6-dihydroxypyrimidine,4-hydroxy-5-nitro-1h-pyrimidin-6-one,4 3h-pyrimidinone, 6-hydroxy-5-nitro |
| IUPAC Name | 6-hydroxy-5-nitro-3,4-dihydropyrimidin-4-one |
| InChI Key | ABTLZAVJDRUDNG-UHFFFAOYSA-N |
| Molecular Formula | C4H3N3O4 |
2-Mercaptopyridine 98.0+%, TCI America™
CAS: 2637-34-5 Molecular Formula: C5H5NS Molecular Weight (g/mol): 111.162 MDL Number: MFCD00006285 InChI Key: WHMDPDGBKYUEMW-UHFFFAOYSA-N Synonym: 2-mercaptopyridine,2-pyridinethiol,pyridine-2-thiol,2-thiopyridine,pyrid-2-thione,2 1h-pyridinethione,pyridinethione,2-thiopyridone,2-pyridinethione,2-mercapto pyridine PubChem CID: 2723698 ChEBI: CHEBI:45223 IUPAC Name: 1H-pyridine-2-thione SMILES: C1=CC(=S)NC=C1
| PubChem CID | 2723698 |
|---|---|
| CAS | 2637-34-5 |
| Molecular Weight (g/mol) | 111.162 |
| ChEBI | CHEBI:45223 |
| MDL Number | MFCD00006285 |
| SMILES | C1=CC(=S)NC=C1 |
| Synonym | 2-mercaptopyridine,2-pyridinethiol,pyridine-2-thiol,2-thiopyridine,pyrid-2-thione,2 1h-pyridinethione,pyridinethione,2-thiopyridone,2-pyridinethione,2-mercapto pyridine |
| IUPAC Name | 1H-pyridine-2-thione |
| InChI Key | WHMDPDGBKYUEMW-UHFFFAOYSA-N |
| Molecular Formula | C5H5NS |
3-Methylpyrazole 97.0+%, TCI America™
CAS: 1453-58-3 Molecular Formula: C4H6N2 Molecular Weight (g/mol): 82.11 MDL Number: MFCD00005240,MFCD08685900 InChI Key: XKVUYEYANWFIJX-UHFFFAOYSA-N Synonym: 3-methylpyrazole,3-methyl-1h-pyrazole,1h-pyrazole, 3-methyl,5-methylpyrazole,3 5-methylpyrazole,pyrazole, 5-methyl,1h-pyrazole,5-methyl,1h-pyrazole, 5-methyl,pyrazole, 3-methyl,unii-w7ku1rro6u PubChem CID: 15073 IUPAC Name: 5-methyl-1H-pyrazole SMILES: CC1=CC=NN1
| PubChem CID | 15073 |
|---|---|
| CAS | 1453-58-3 |
| Molecular Weight (g/mol) | 82.11 |
| MDL Number | MFCD00005240,MFCD08685900 |
| SMILES | CC1=CC=NN1 |
| Synonym | 3-methylpyrazole,3-methyl-1h-pyrazole,1h-pyrazole, 3-methyl,5-methylpyrazole,3 5-methylpyrazole,pyrazole, 5-methyl,1h-pyrazole,5-methyl,1h-pyrazole, 5-methyl,pyrazole, 3-methyl,unii-w7ku1rro6u |
| IUPAC Name | 5-methyl-1H-pyrazole |
| InChI Key | XKVUYEYANWFIJX-UHFFFAOYSA-N |
| Molecular Formula | C4H6N2 |
Loratadine 98.0+%, TCI America™
CAS: 79794-75-5 Molecular Formula: C22H23ClN2O2 Molecular Weight (g/mol): 382.888 MDL Number: MFCD00672869 InChI Key: JCCNYMKQOSZNPW-UHFFFAOYSA-N Synonym: loratadine,claritin,loratidine,alavert,clarityn,lisino,clarityne,loracert,loradex,bonalerg PubChem CID: 3957 IUPAC Name: ethyl 4-(8-chloro-5,6-dihydrobenzo[1,2]cyclohepta[2,4-b]pyridin-11-ylidene)piperidine-1-carboxylate SMILES: CCOC(=O)N1CCC(=C2C3=C(CCC4=C2N=CC=C4)C=C(C=C3)Cl)CC1
| PubChem CID | 3957 |
|---|---|
| CAS | 79794-75-5 |
| Molecular Weight (g/mol) | 382.888 |
| MDL Number | MFCD00672869 |
| SMILES | CCOC(=O)N1CCC(=C2C3=C(CCC4=C2N=CC=C4)C=C(C=C3)Cl)CC1 |
| Synonym | loratadine,claritin,loratidine,alavert,clarityn,lisino,clarityne,loracert,loradex,bonalerg |
| IUPAC Name | ethyl 4-(8-chloro-5,6-dihydrobenzo[1,2]cyclohepta[2,4-b]pyridin-11-ylidene)piperidine-1-carboxylate |
| InChI Key | JCCNYMKQOSZNPW-UHFFFAOYSA-N |
| Molecular Formula | C22H23ClN2O2 |
Ethyl 6-Chloronicotinate 97.0+%, TCI America™
CAS: 49608-01-7 Molecular Formula: C8H8ClNO2 Molecular Weight (g/mol): 185.61 MDL Number: MFCD00082739 InChI Key: ILDJJTQWIZLGPO-UHFFFAOYSA-N Synonym: ethyl 6-chloronicotinate,ethyl 6-chloro-3-pyridinecarboxylate,ethyl6-chloronicotinate,6-chloro-nicotinic acid ethyl ester,6-chloronicotinic acid ethyl ester,ethyl 6-chloro nicotinate,ethyl 2-chloro-5-pyridinecarboxylate,3-pyridinecarboxylic acid, 6-chloro-, ethyl ester,pubchem1415,pubchem15179 PubChem CID: 2799611 IUPAC Name: ethyl 6-chloropyridine-3-carboxylate SMILES: CCOC(=O)C1=CC=C(Cl)N=C1
| PubChem CID | 2799611 |
|---|---|
| CAS | 49608-01-7 |
| Molecular Weight (g/mol) | 185.61 |
| MDL Number | MFCD00082739 |
| SMILES | CCOC(=O)C1=CC=C(Cl)N=C1 |
| Synonym | ethyl 6-chloronicotinate,ethyl 6-chloro-3-pyridinecarboxylate,ethyl6-chloronicotinate,6-chloro-nicotinic acid ethyl ester,6-chloronicotinic acid ethyl ester,ethyl 6-chloro nicotinate,ethyl 2-chloro-5-pyridinecarboxylate,3-pyridinecarboxylic acid, 6-chloro-, ethyl ester,pubchem1415,pubchem15179 |
| IUPAC Name | ethyl 6-chloropyridine-3-carboxylate |
| InChI Key | ILDJJTQWIZLGPO-UHFFFAOYSA-N |
| Molecular Formula | C8H8ClNO2 |
3-Ethynylthiophene 97.0+%, TCI America™
CAS: 67237-53-0 Molecular Formula: C6H4S Molecular Weight (g/mol): 108.158 MDL Number: MFCD04039973 InChI Key: MJHLPKWONJUCFK-UHFFFAOYSA-N Synonym: 3-ethynyl thiophene,thiophene, 3-ethynyl,3-thienylacetylene,thiophen-3-yl acetylene,3-ethynyl-thiophene,3-ethynyl thiophene;,pubchem16122,thien-3-yl acetylene,3-ethynylthiophene,ksc352m9b PubChem CID: 3548422 IUPAC Name: 3-ethynylthiophene SMILES: C#CC1=CSC=C1
| PubChem CID | 3548422 |
|---|---|
| CAS | 67237-53-0 |
| Molecular Weight (g/mol) | 108.158 |
| MDL Number | MFCD04039973 |
| SMILES | C#CC1=CSC=C1 |
| Synonym | 3-ethynyl thiophene,thiophene, 3-ethynyl,3-thienylacetylene,thiophen-3-yl acetylene,3-ethynyl-thiophene,3-ethynyl thiophene;,pubchem16122,thien-3-yl acetylene,3-ethynylthiophene,ksc352m9b |
| IUPAC Name | 3-ethynylthiophene |
| InChI Key | MJHLPKWONJUCFK-UHFFFAOYSA-N |
| Molecular Formula | C6H4S |
2-Methylbenzimidazole 98.0+%, TCI America™
CAS: 615-15-6 Molecular Formula: C8H8N2 Molecular Weight (g/mol): 132.17 MDL Number: MFCD00005598 InChI Key: LDZYRENCLPUXAX-UHFFFAOYSA-N Synonym: 2-methylbenzimidazole,2-methyl-1h-benzo d imidazole,1h-benzimidazole, 2-methyl,benzimidazole, 2-methyl,2-methyl-1h-benzoimidazole,2-methyl-1h-1,3-benzodiazole,acetamidine, n-n'-o-phenylene,2-methyl benzimidazole,unii-zh8iww7y8b,2-methylbenaimidazole PubChem CID: 11984 IUPAC Name: 2-methyl-1H-1,3-benzodiazole SMILES: CC1=NC2=CC=CC=C2N1
| PubChem CID | 11984 |
|---|---|
| CAS | 615-15-6 |
| Molecular Weight (g/mol) | 132.17 |
| MDL Number | MFCD00005598 |
| SMILES | CC1=NC2=CC=CC=C2N1 |
| Synonym | 2-methylbenzimidazole,2-methyl-1h-benzo d imidazole,1h-benzimidazole, 2-methyl,benzimidazole, 2-methyl,2-methyl-1h-benzoimidazole,2-methyl-1h-1,3-benzodiazole,acetamidine, n-n'-o-phenylene,2-methyl benzimidazole,unii-zh8iww7y8b,2-methylbenaimidazole |
| IUPAC Name | 2-methyl-1H-1,3-benzodiazole |
| InChI Key | LDZYRENCLPUXAX-UHFFFAOYSA-N |
| Molecular Formula | C8H8N2 |
2-Methylfuran 98.0+%, TCI America™
CAS: 534-22-5 Molecular Formula: C5H6O Molecular Weight (g/mol): 82.102 MDL Number: MFCD00003248 InChI Key: VQKFNUFAXTZWDK-UHFFFAOYSA-N Synonym: methylfuran,sylvan,2-methyl furan,silvan,furan, 2-methyl,5-methylfuran,alpha-methylfuran,furan, methyl,silvan czech,.alpha.-methylfuran PubChem CID: 10797 IUPAC Name: 2-methylfuran SMILES: CC1=CC=CO1
| PubChem CID | 10797 |
|---|---|
| CAS | 534-22-5 |
| Molecular Weight (g/mol) | 82.102 |
| MDL Number | MFCD00003248 |
| SMILES | CC1=CC=CO1 |
| Synonym | methylfuran,sylvan,2-methyl furan,silvan,furan, 2-methyl,5-methylfuran,alpha-methylfuran,furan, methyl,silvan czech,.alpha.-methylfuran |
| IUPAC Name | 2-methylfuran |
| InChI Key | VQKFNUFAXTZWDK-UHFFFAOYSA-N |
| Molecular Formula | C5H6O |
1,3-Butadiene Monoepoxide 97.0+%, TCI America™
CAS: 930-22-3 Molecular Formula: C4H6O Molecular Weight (g/mol): 70.091 MDL Number: MFCD00005149 InChI Key: GXBYFVGCMPJVJX-UHFFFAOYSA-N Synonym: butadiene monoxide,oxirane, ethenyl,3,4-epoxy-1-butene,2-vinyloxirane,butadiene epoxide,1,2-epoxy-3-butene,vinyloxirane,butadiene oxide,butadiene monoepoxide,butadiene monooxide PubChem CID: 13586 IUPAC Name: 2-ethenyloxirane SMILES: C=CC1CO1
| PubChem CID | 13586 |
|---|---|
| CAS | 930-22-3 |
| Molecular Weight (g/mol) | 70.091 |
| MDL Number | MFCD00005149 |
| SMILES | C=CC1CO1 |
| Synonym | butadiene monoxide,oxirane, ethenyl,3,4-epoxy-1-butene,2-vinyloxirane,butadiene epoxide,1,2-epoxy-3-butene,vinyloxirane,butadiene oxide,butadiene monoepoxide,butadiene monooxide |
| IUPAC Name | 2-ethenyloxirane |
| InChI Key | GXBYFVGCMPJVJX-UHFFFAOYSA-N |
| Molecular Formula | C4H6O |
Ethyl 2-Amino-4-methylthiazole-5-carboxylate 98.0+%, TCI America™
CAS: 7210-76-6 Molecular Formula: C7H10N2O2S Molecular Weight (g/mol): 186.23 MDL Number: MFCD00123414 InChI Key: WZHUPCREDVWLKC-UHFFFAOYSA-N Synonym: ethyl 2-amino-4-methylthiazole-5-carboxylate,ethyl2-amino-4-methylthiazole-5-carboxylate,2-amino-4-methyl-thiazole-5-carboxylic acid ethyl ester,5-thiazolecarboxylic acid, 2-amino-4-methyl-, ethyl ester,ethyl 2-amino-4-methyl thiazole-5-carboxylate,ethyl 2-amino-4-methyl-thiazole-5-carboxylate,2-amino-4-methyl-5-thiazolecarboxylic acid ethyl ester,2-amino-4-methyl-5-ethoxycarbonyl thiazole,2-amino-4-methyl-5-ethoxycarbonyl-thiazole,ethyl 2-amino-4-methyl-5-thiazolecarboxylate PubChem CID: 343747 IUPAC Name: ethyl 2-amino-4-methyl-1,3-thiazole-5-carboxylate SMILES: CCOC(=O)C1=C(C)N=C(N)S1
| PubChem CID | 343747 |
|---|---|
| CAS | 7210-76-6 |
| Molecular Weight (g/mol) | 186.23 |
| MDL Number | MFCD00123414 |
| SMILES | CCOC(=O)C1=C(C)N=C(N)S1 |
| Synonym | ethyl 2-amino-4-methylthiazole-5-carboxylate,ethyl2-amino-4-methylthiazole-5-carboxylate,2-amino-4-methyl-thiazole-5-carboxylic acid ethyl ester,5-thiazolecarboxylic acid, 2-amino-4-methyl-, ethyl ester,ethyl 2-amino-4-methyl thiazole-5-carboxylate,ethyl 2-amino-4-methyl-thiazole-5-carboxylate,2-amino-4-methyl-5-thiazolecarboxylic acid ethyl ester,2-amino-4-methyl-5-ethoxycarbonyl thiazole,2-amino-4-methyl-5-ethoxycarbonyl-thiazole,ethyl 2-amino-4-methyl-5-thiazolecarboxylate |
| IUPAC Name | ethyl 2-amino-4-methyl-1,3-thiazole-5-carboxylate |
| InChI Key | WZHUPCREDVWLKC-UHFFFAOYSA-N |
| Molecular Formula | C7H10N2O2S |