Organoheterocyclic compounds
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5-Phenyltetrazole 99.0+%, TCI America™
CAS: 18039-42-4 Molecular Formula: C7H6N4 Molecular Weight (g/mol): 146.153 MDL Number: MFCD00022388 InChI Key: MARUHZGHZWCEQU-UHFFFAOYSA-N Synonym: 5-phenyl-1h-tetrazole,5-phenyltetrazole,1h-tetrazole, 5-phenyl,2h-tetrazole, 5-phenyl,phenyltetrazole,5-phenyl tetrazole,expandex 5pt,expandex ox 5pt,kempore 50xpt,5-phenyltetrazole van PubChem CID: 87425 IUPAC Name: 5-phenyl-2H-tetrazole SMILES: C1=CC=C(C=C1)C2=NNN=N2
| PubChem CID | 87425 |
|---|---|
| CAS | 18039-42-4 |
| Molecular Weight (g/mol) | 146.153 |
| MDL Number | MFCD00022388 |
| SMILES | C1=CC=C(C=C1)C2=NNN=N2 |
| Synonym | 5-phenyl-1h-tetrazole,5-phenyltetrazole,1h-tetrazole, 5-phenyl,2h-tetrazole, 5-phenyl,phenyltetrazole,5-phenyl tetrazole,expandex 5pt,expandex ox 5pt,kempore 50xpt,5-phenyltetrazole van |
| IUPAC Name | 5-phenyl-2H-tetrazole |
| InChI Key | MARUHZGHZWCEQU-UHFFFAOYSA-N |
| Molecular Formula | C7H6N4 |
1-Piperonylpiperazine 97.0+%, TCI America™
CAS: 32231-06-4 Molecular Formula: C12H16N2O2 Molecular Weight (g/mol): 220.272 MDL Number: MFCD00005834 InChI Key: NBOOZXVYXHATOW-UHFFFAOYSA-N Synonym: 1-piperonylpiperazine,1-3,4-methylenedioxybenzyl piperazine,1-benzo d 1,3 dioxol-5-ylmethyl piperazine,1-1,3-benzodioxol-5-ylmethyl piperazine,1-1,3-benzodioxol-5-yl-methyl piperazine,1-benzo 1,3 dioxol-5-ylmethyl-piperazine,piperazine, 1-1,3-benzodioxol-5-ylmethyl,1-3,4-methylendioxybenzyl piperazine,piperazine, 1-3,4-methylenedioxybenzyl,5-piperazinylmethyl-2h-benzo d 1,3-dioxolene PubChem CID: 94426 IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)piperazine SMILES: C1CN(CCN1)CC2=CC3=C(C=C2)OCO3
| PubChem CID | 94426 |
|---|---|
| CAS | 32231-06-4 |
| Molecular Weight (g/mol) | 220.272 |
| MDL Number | MFCD00005834 |
| SMILES | C1CN(CCN1)CC2=CC3=C(C=C2)OCO3 |
| Synonym | 1-piperonylpiperazine,1-3,4-methylenedioxybenzyl piperazine,1-benzo d 1,3 dioxol-5-ylmethyl piperazine,1-1,3-benzodioxol-5-ylmethyl piperazine,1-1,3-benzodioxol-5-yl-methyl piperazine,1-benzo 1,3 dioxol-5-ylmethyl-piperazine,piperazine, 1-1,3-benzodioxol-5-ylmethyl,1-3,4-methylendioxybenzyl piperazine,piperazine, 1-3,4-methylenedioxybenzyl,5-piperazinylmethyl-2h-benzo d 1,3-dioxolene |
| IUPAC Name | 1-(1,3-benzodioxol-5-ylmethyl)piperazine |
| InChI Key | NBOOZXVYXHATOW-UHFFFAOYSA-N |
| Molecular Formula | C12H16N2O2 |
Pyrazole-3,5-dicarboxylic Acid Monohydrate 98.0+%, TCI America™
CAS: 3112-31-0 Molecular Formula: C5H4N2O4 Molecular Weight (g/mol): 156.097 MDL Number: MFCD00005235 InChI Key: YDMVPJZBYSWOOP-UHFFFAOYSA-N Synonym: 3,5-pyrazoledicarboxylic acid,pyrazole-3,5-dicarboxylic acid,pyrazole-3,5-dicarboxylic acid monohydrate,3,5-pyrazol dicarboxylic acid,3,5-pyrazole dicarboxylic acid,zlchem 726,3,5-dicarboxypyrazole,acmc-20a0hc,ksc223c6j,3,5-pyrazole-dicarboxylic acid PubChem CID: 76559 IUPAC Name: 1H-pyrazole-3,5-dicarboxylic acid SMILES: C1=C(NN=C1C(=O)O)C(=O)O
| PubChem CID | 76559 |
|---|---|
| CAS | 3112-31-0 |
| Molecular Weight (g/mol) | 156.097 |
| MDL Number | MFCD00005235 |
| SMILES | C1=C(NN=C1C(=O)O)C(=O)O |
| Synonym | 3,5-pyrazoledicarboxylic acid,pyrazole-3,5-dicarboxylic acid,pyrazole-3,5-dicarboxylic acid monohydrate,3,5-pyrazol dicarboxylic acid,3,5-pyrazole dicarboxylic acid,zlchem 726,3,5-dicarboxypyrazole,acmc-20a0hc,ksc223c6j,3,5-pyrazole-dicarboxylic acid |
| IUPAC Name | 1H-pyrazole-3,5-dicarboxylic acid |
| InChI Key | YDMVPJZBYSWOOP-UHFFFAOYSA-N |
| Molecular Formula | C5H4N2O4 |
1-(2-Pyridyl)piperazine 98.0+%, TCI America™
CAS: 34803-66-2 Molecular Formula: C9H13N3 Molecular Weight (g/mol): 163.224 MDL Number: MFCD00006216 InChI Key: GZRKXKUVVPSREJ-UHFFFAOYSA-N Synonym: 1-2-pyridyl piperazine,1-pyridin-2-yl piperazine,1-pyridin-2-yl-piperazine,1-2-pyridinyl piperazine,piperazine, 1-2-pyridinyl,2-pyridylpiperazine,pyridinylpiperazine,2-1-piperazinyl pyridine PubChem CID: 94459 IUPAC Name: 1-pyridin-2-ylpiperazine SMILES: C1CN(CCN1)C2=CC=CC=N2
| PubChem CID | 94459 |
|---|---|
| CAS | 34803-66-2 |
| Molecular Weight (g/mol) | 163.224 |
| MDL Number | MFCD00006216 |
| SMILES | C1CN(CCN1)C2=CC=CC=N2 |
| Synonym | 1-2-pyridyl piperazine,1-pyridin-2-yl piperazine,1-pyridin-2-yl-piperazine,1-2-pyridinyl piperazine,piperazine, 1-2-pyridinyl,2-pyridylpiperazine,pyridinylpiperazine,2-1-piperazinyl pyridine |
| IUPAC Name | 1-pyridin-2-ylpiperazine |
| InChI Key | GZRKXKUVVPSREJ-UHFFFAOYSA-N |
| Molecular Formula | C9H13N3 |
Phenanthridine 98.0+%, TCI America™
CAS: 229-87-8 Molecular Formula: C13H9N Molecular Weight (g/mol): 179.222 MDL Number: MFCD00004989 InChI Key: RDOWQLZANAYVLL-UHFFFAOYSA-N Synonym: 6-phenanthridine,benzo c quinoline,3,4-benzoquinoline,9-azaphenanthrene,3,4-benzoisoquinoline,5-azaphenanthrene,unii-62qgs7cps6,ccris 1234,62qgs7cps6 PubChem CID: 9189 ChEBI: CHEBI:36421 IUPAC Name: phenanthridine SMILES: C1=CC=C2C(=C1)C=NC3=CC=CC=C23
| PubChem CID | 9189 |
|---|---|
| CAS | 229-87-8 |
| Molecular Weight (g/mol) | 179.222 |
| ChEBI | CHEBI:36421 |
| MDL Number | MFCD00004989 |
| SMILES | C1=CC=C2C(=C1)C=NC3=CC=CC=C23 |
| Synonym | 6-phenanthridine,benzo c quinoline,3,4-benzoquinoline,9-azaphenanthrene,3,4-benzoisoquinoline,5-azaphenanthrene,unii-62qgs7cps6,ccris 1234,62qgs7cps6 |
| IUPAC Name | phenanthridine |
| InChI Key | RDOWQLZANAYVLL-UHFFFAOYSA-N |
| Molecular Formula | C13H9N |
1-(2-Pyrimidyl)piperazine 98.0+%, TCI America™
CAS: 20980-22-7 Molecular Formula: C8H12N4 Molecular Weight (g/mol): 164.212 MDL Number: MFCD00040742 InChI Key: MRBFGEHILMYPTF-UHFFFAOYSA-N Synonym: 2-1-piperazinyl pyrimidine,1-2-pyrimidyl piperazine,2-piperazin-1-yl pyrimidine,1-2-pyrimidinyl piperazine,2-piperazinopyrimidine,campiron,pyrimidine, 2-1-piperazinyl,campirone,kampirone,2-piperazin-1-yl-pyrimidine PubChem CID: 88747 IUPAC Name: 2-piperazin-1-ylpyrimidine SMILES: C1CN(CCN1)C2=NC=CC=N2
| PubChem CID | 88747 |
|---|---|
| CAS | 20980-22-7 |
| Molecular Weight (g/mol) | 164.212 |
| MDL Number | MFCD00040742 |
| SMILES | C1CN(CCN1)C2=NC=CC=N2 |
| Synonym | 2-1-piperazinyl pyrimidine,1-2-pyrimidyl piperazine,2-piperazin-1-yl pyrimidine,1-2-pyrimidinyl piperazine,2-piperazinopyrimidine,campiron,pyrimidine, 2-1-piperazinyl,campirone,kampirone,2-piperazin-1-yl-pyrimidine |
| IUPAC Name | 2-piperazin-1-ylpyrimidine |
| InChI Key | MRBFGEHILMYPTF-UHFFFAOYSA-N |
| Molecular Formula | C8H12N4 |
3-Pentylthiophene 97.0+%, TCI America™
CAS: 102871-31-8 Molecular Formula: C9H14S Molecular Weight (g/mol): 154.271 MDL Number: MFCD00143182 InChI Key: PIQKSZYJGUXAQF-UHFFFAOYSA-N PubChem CID: 15345429 IUPAC Name: 3-pentylthiophene SMILES: CCCCCC1=CSC=C1
| PubChem CID | 15345429 |
|---|---|
| CAS | 102871-31-8 |
| Molecular Weight (g/mol) | 154.271 |
| MDL Number | MFCD00143182 |
| SMILES | CCCCCC1=CSC=C1 |
| IUPAC Name | 3-pentylthiophene |
| InChI Key | PIQKSZYJGUXAQF-UHFFFAOYSA-N |
| Molecular Formula | C9H14S |
3-Phenylphthalide 98.0+%, TCI America™
CAS: 5398-11-8 Molecular Formula: C14H10O2 Molecular Weight (g/mol): 210.23 MDL Number: MFCD00023099 InChI Key: SQFMIHCARVMICF-UHFFFAOYNA-N Synonym: 3-phenylphthalide,3-phenyl phthalide,phthalide, 3-phenyl,3-phenyl-2-benzofuran-1 3h-one,3-phenyl-1 3h-isobenzofuranone,3-phenyl-1,3-dihydro-2-benzofuran-1-one,1 3h-isobenzofuranone, 3-phenyl,3-phenyl-3-hydroisobenzofuran-1-one,phenylphthalid,acmc-1ak9n PubChem CID: 95365 IUPAC Name: 3-phenyl-3H-2-benzofuran-1-one SMILES: C1=CC=C(C=C1)C2C3=CC=CC=C3C(=O)O2
| PubChem CID | 95365 |
|---|---|
| CAS | 5398-11-8 |
| Molecular Weight (g/mol) | 210.23 |
| MDL Number | MFCD00023099 |
| SMILES | C1=CC=C(C=C1)C2C3=CC=CC=C3C(=O)O2 |
| Synonym | 3-phenylphthalide,3-phenyl phthalide,phthalide, 3-phenyl,3-phenyl-2-benzofuran-1 3h-one,3-phenyl-1 3h-isobenzofuranone,3-phenyl-1,3-dihydro-2-benzofuran-1-one,1 3h-isobenzofuranone, 3-phenyl,3-phenyl-3-hydroisobenzofuran-1-one,phenylphthalid,acmc-1ak9n |
| IUPAC Name | 3-phenyl-3H-2-benzofuran-1-one |
| InChI Key | SQFMIHCARVMICF-UHFFFAOYNA-N |
| Molecular Formula | C14H10O2 |
9H-Pyrido[3,4-b]indole 98.0+%, TCI America™
CAS: 244-63-3 Molecular Formula: C11H8N2 Molecular Weight (g/mol): 168.20 MDL Number: MFCD00004956 InChI Key: AIFRHYZBTHREPW-UHFFFAOYSA-N Synonym: 9h-pyrido 3,4-b indole,norharman,norharmane,beta-carboline,carbazoline,2,9-diazafluorene,9h-beta-carboline,2-azacarbazole,.beta.-carboline PubChem CID: 64961 ChEBI: CHEBI:109895 IUPAC Name: 9H-pyrido[3,4-b]indole SMILES: N1C2=C(C=CC=C2)C2=C1C=NC=C2
| PubChem CID | 64961 |
|---|---|
| CAS | 244-63-3 |
| Molecular Weight (g/mol) | 168.20 |
| ChEBI | CHEBI:109895 |
| MDL Number | MFCD00004956 |
| SMILES | N1C2=C(C=CC=C2)C2=C1C=NC=C2 |
| Synonym | 9h-pyrido 3,4-b indole,norharman,norharmane,beta-carboline,carbazoline,2,9-diazafluorene,9h-beta-carboline,2-azacarbazole,.beta.-carboline |
| IUPAC Name | 9H-pyrido[3,4-b]indole |
| InChI Key | AIFRHYZBTHREPW-UHFFFAOYSA-N |
| Molecular Formula | C11H8N2 |
3-Propylthiophene 97.0+%, TCI America™
CAS: 1518-75-8 Molecular Formula: C7H10S Molecular Weight (g/mol): 126.22 MDL Number: MFCD00143183 InChI Key: QZNFRMXKQCIPQY-UHFFFAOYSA-N PubChem CID: 519073 IUPAC Name: 3-propylthiophene SMILES: CCCC1=CSC=C1
| PubChem CID | 519073 |
|---|---|
| CAS | 1518-75-8 |
| Molecular Weight (g/mol) | 126.22 |
| MDL Number | MFCD00143183 |
| SMILES | CCCC1=CSC=C1 |
| IUPAC Name | 3-propylthiophene |
| InChI Key | QZNFRMXKQCIPQY-UHFFFAOYSA-N |
| Molecular Formula | C7H10S |
3-Phenylthiophene 95.0+%, TCI America™
CAS: 2404-87-7 Molecular Formula: C10H8S Molecular Weight (g/mol): 160.23 MDL Number: MFCD00114997 InChI Key: ZDQZVKVIYAPRON-UHFFFAOYSA-N PubChem CID: 75473 IUPAC Name: 3-phenylthiophene SMILES: S1C=CC(=C1)C1=CC=CC=C1
| PubChem CID | 75473 |
|---|---|
| CAS | 2404-87-7 |
| Molecular Weight (g/mol) | 160.23 |
| MDL Number | MFCD00114997 |
| SMILES | S1C=CC(=C1)C1=CC=CC=C1 |
| IUPAC Name | 3-phenylthiophene |
| InChI Key | ZDQZVKVIYAPRON-UHFFFAOYSA-N |
| Molecular Formula | C10H8S |
N-Phthaloyl-DL-glutamic Anhydride 98.0+%, TCI America™
CAS: 3343-28-0 Molecular Formula: C13H9NO5 Molecular Weight (g/mol): 259.22 MDL Number: MFCD00005886 InChI Key: ICDLEMPZXFCQEB-UHFFFAOYNA-N Synonym: 2-Phthalimidoglutaric Anhydride PubChem CID: 92193 IUPAC Name: 2-(2,6-dioxooxan-3-yl)-2,3-dihydro-1H-isoindole-1,3-dione SMILES: O=C1N(C2CCC(=O)OC2=O)C(=O)C2=CC=CC=C12
| PubChem CID | 92193 |
|---|---|
| CAS | 3343-28-0 |
| Molecular Weight (g/mol) | 259.22 |
| MDL Number | MFCD00005886 |
| SMILES | O=C1N(C2CCC(=O)OC2=O)C(=O)C2=CC=CC=C12 |
| Synonym | 2-Phthalimidoglutaric Anhydride |
| IUPAC Name | 2-(2,6-dioxooxan-3-yl)-2,3-dihydro-1H-isoindole-1,3-dione |
| InChI Key | ICDLEMPZXFCQEB-UHFFFAOYNA-N |
| Molecular Formula | C13H9NO5 |
Benzoguanamine 99.0+%, TCI America™
CAS: 91-76-9 Molecular Formula: C9H9N5 Molecular Weight (g/mol): 187.21 MDL Number: MFCD00023187 InChI Key: GZVHEAJQGPRDLQ-UHFFFAOYSA-N Synonym: benzoguanamine,2,4-diamino-6-phenyl-1,3,5-triazine,benzoguanimine,1,3,5-triazine-2,4-diamine, 6-phenyl,usaf rh-5,2,4-diamino-6-phenyl-s-triazine,2-phenyl-4,6-diamino-s-triazine,4,6-diamino-2-phenyl-s-triazine,benzoguanamine van,s-triazine, 2,4-diamino-6-phenyl PubChem CID: 7064 IUPAC Name: 6-phenyl-1,3,5-triazine-2,4-diamine SMILES: NC1=NC(=NC(N)=N1)C1=CC=CC=C1
| PubChem CID | 7064 |
|---|---|
| CAS | 91-76-9 |
| Molecular Weight (g/mol) | 187.21 |
| MDL Number | MFCD00023187 |
| SMILES | NC1=NC(=NC(N)=N1)C1=CC=CC=C1 |
| Synonym | benzoguanamine,2,4-diamino-6-phenyl-1,3,5-triazine,benzoguanimine,1,3,5-triazine-2,4-diamine, 6-phenyl,usaf rh-5,2,4-diamino-6-phenyl-s-triazine,2-phenyl-4,6-diamino-s-triazine,4,6-diamino-2-phenyl-s-triazine,benzoguanamine van,s-triazine, 2,4-diamino-6-phenyl |
| IUPAC Name | 6-phenyl-1,3,5-triazine-2,4-diamine |
| InChI Key | GZVHEAJQGPRDLQ-UHFFFAOYSA-N |
| Molecular Formula | C9H9N5 |
1H-Pyrrolo[3,2-c]pyridine 98.0+%, TCI America™
CAS: 271-34-1 Molecular Formula: C7H6N2 Molecular Weight (g/mol): 118.139 MDL Number: MFCD00955936 InChI Key: SRSKXJVMVSSSHB-UHFFFAOYSA-N Synonym: 5-azaindole,1h-pyrrolo 3,2-c pyridine,1,5-diazaindene,3,7-dideazapurine,5-azindole,5h-pyrrolo 3,2-c pyridine,pyrrolo 3,2-c pyridine,5-aza indole,5-aza-indole PubChem CID: 9220 IUPAC Name: 1H-pyrrolo[3,2-c]pyridine SMILES: C1=CNC2=C1C=NC=C2
| PubChem CID | 9220 |
|---|---|
| CAS | 271-34-1 |
| Molecular Weight (g/mol) | 118.139 |
| MDL Number | MFCD00955936 |
| SMILES | C1=CNC2=C1C=NC=C2 |
| Synonym | 5-azaindole,1h-pyrrolo 3,2-c pyridine,1,5-diazaindene,3,7-dideazapurine,5-azindole,5h-pyrrolo 3,2-c pyridine,pyrrolo 3,2-c pyridine,5-aza indole,5-aza-indole |
| IUPAC Name | 1H-pyrrolo[3,2-c]pyridine |
| InChI Key | SRSKXJVMVSSSHB-UHFFFAOYSA-N |
| Molecular Formula | C7H6N2 |
Pyrimethamine 98.0+%, TCI America™
CAS: 58-14-0 Molecular Formula: C12H13ClN4 Molecular Weight (g/mol): 248.71 MDL Number: MFCD00057350 InChI Key: WKSAUQYGYAYLPV-UHFFFAOYSA-N Synonym: pyrimethamine,chloridine,daraprim,chloridin,diaminopyritamin,5-4-chlorophenyl-6-ethylpyrimidine-2,4-diamine,ethylpyrimidine,pirimetamina,chloridyn,malocide PubChem CID: 4993 ChEBI: CHEBI:8673 IUPAC Name: 5-(4-chlorophenyl)-6-ethylpyrimidine-2,4-diamine SMILES: CCC1=NC(N)=NC(N)=C1C1=CC=C(Cl)C=C1
| PubChem CID | 4993 |
|---|---|
| CAS | 58-14-0 |
| Molecular Weight (g/mol) | 248.71 |
| ChEBI | CHEBI:8673 |
| MDL Number | MFCD00057350 |
| SMILES | CCC1=NC(N)=NC(N)=C1C1=CC=C(Cl)C=C1 |
| Synonym | pyrimethamine,chloridine,daraprim,chloridin,diaminopyritamin,5-4-chlorophenyl-6-ethylpyrimidine-2,4-diamine,ethylpyrimidine,pirimetamina,chloridyn,malocide |
| IUPAC Name | 5-(4-chlorophenyl)-6-ethylpyrimidine-2,4-diamine |
| InChI Key | WKSAUQYGYAYLPV-UHFFFAOYSA-N |
| Molecular Formula | C12H13ClN4 |