Organoheterocyclic compounds
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Pyridinium p-toluenesulfonate, 98%
CAS: 24057-28-1 Molecular Formula: C12H13NO3S Molecular Weight (g/mol): 251.3 MDL Number: MFCD00013108 Synonym: pyridinium p-toluenesulfonate,ppts,pyridin-1-ium 4-methylbenzenesulfonate,pyridinium 4-toluenesulfonate,pyridinium tosylate,pyridinium 4-methylbenzenesulfonate,pyridinium p-toluene sulfonate,pyridinium p-toluene sulphonate,pyridinium para-toluenesulfonate,4-toluenesulfonic acid pyridine salt
| CAS | 24057-28-1 |
|---|---|
| Molecular Weight (g/mol) | 251.3 |
| MDL Number | MFCD00013108 |
| Synonym | pyridinium p-toluenesulfonate,ppts,pyridin-1-ium 4-methylbenzenesulfonate,pyridinium 4-toluenesulfonate,pyridinium tosylate,pyridinium 4-methylbenzenesulfonate,pyridinium p-toluene sulfonate,pyridinium p-toluene sulphonate,pyridinium para-toluenesulfonate,4-toluenesulfonic acid pyridine salt |
| Molecular Formula | C12H13NO3S |
3-Aminopyridine, 99%
CAS: 462-08-8 Molecular Formula: C5H6N2 Molecular Weight (g/mol): 94.12 MDL Number: MFCD00006400 InChI Key: CUYKNJBYIJFRCU-UHFFFAOYSA-N Synonym: 3-aminopyridine,3-pyridinamine,3-pyridylamine,pyridin-3-ylamine,m-aminopyridine,amino-3 pyridine,pyridine, 3-amino,3-amino pyridine,beta-aminopyridine,amino-3-pyridine PubChem CID: 10009 IUPAC Name: pyridin-3-amine SMILES: NC1=CC=CN=C1
| PubChem CID | 10009 |
|---|---|
| CAS | 462-08-8 |
| Molecular Weight (g/mol) | 94.12 |
| MDL Number | MFCD00006400 |
| SMILES | NC1=CC=CN=C1 |
| Synonym | 3-aminopyridine,3-pyridinamine,3-pyridylamine,pyridin-3-ylamine,m-aminopyridine,amino-3 pyridine,pyridine, 3-amino,3-amino pyridine,beta-aminopyridine,amino-3-pyridine |
| IUPAC Name | pyridin-3-amine |
| InChI Key | CUYKNJBYIJFRCU-UHFFFAOYSA-N |
| Molecular Formula | C5H6N2 |
2,2'-Biquinoline, 98%
CAS: 119-91-5 Molecular Formula: C18H12N2 Molecular Weight (g/mol): 256.3 MDL Number: MFCD00006740 InChI Key: WPTCSQBWLUUYDV-UHFFFAOYSA-N Synonym: 2,2'-biquinoline,cuproin,cuproine,2,2'-diquinolyl,2,2'-biquinolyl,2,2'-quinolyl,2-2-quinolyl quinoline,2,2-biquinoline,2,2-diquinolyl,2,2;-biquinoline PubChem CID: 8412 IUPAC Name: 2-quinolin-2-ylquinoline SMILES: C1=CC=C2C(=C1)C=CC(=N2)C3=NC4=CC=CC=C4C=C3
| PubChem CID | 8412 |
|---|---|
| CAS | 119-91-5 |
| Molecular Weight (g/mol) | 256.3 |
| MDL Number | MFCD00006740 |
| SMILES | C1=CC=C2C(=C1)C=CC(=N2)C3=NC4=CC=CC=C4C=C3 |
| Synonym | 2,2'-biquinoline,cuproin,cuproine,2,2'-diquinolyl,2,2'-biquinolyl,2,2'-quinolyl,2-2-quinolyl quinoline,2,2-biquinoline,2,2-diquinolyl,2,2;-biquinoline |
| IUPAC Name | 2-quinolin-2-ylquinoline |
| InChI Key | WPTCSQBWLUUYDV-UHFFFAOYSA-N |
| Molecular Formula | C18H12N2 |
2-Cyanopyridine, 99%
CAS: 100-70-9 Molecular Formula: C6H4N2 Molecular Weight (g/mol): 104.11 MDL Number: MFCD00006218 InChI Key: FFNVQNRYTPFDDP-UHFFFAOYSA-N Synonym: 2-cyanopyridine,picolinonitrile,2-pyridinecarbonitrile,pyridinecarbonitrile,2-pyridyl nitrile,picolinic acid nitrile,cyanopyridine,unii-whr1dpg7ys,2-pyridinecarboxylic acid, nitrile,2-cyano pyridine PubChem CID: 7522 ChEBI: CHEBI:27837 IUPAC Name: pyridine-2-carbonitrile SMILES: C1=CC=NC(=C1)C#N
| PubChem CID | 7522 |
|---|---|
| CAS | 100-70-9 |
| Molecular Weight (g/mol) | 104.11 |
| ChEBI | CHEBI:27837 |
| MDL Number | MFCD00006218 |
| SMILES | C1=CC=NC(=C1)C#N |
| Synonym | 2-cyanopyridine,picolinonitrile,2-pyridinecarbonitrile,pyridinecarbonitrile,2-pyridyl nitrile,picolinic acid nitrile,cyanopyridine,unii-whr1dpg7ys,2-pyridinecarboxylic acid, nitrile,2-cyano pyridine |
| IUPAC Name | pyridine-2-carbonitrile |
| InChI Key | FFNVQNRYTPFDDP-UHFFFAOYSA-N |
| Molecular Formula | C6H4N2 |
Theophylline, Anhydrous, USP, 97-102%, Spectrum™ Chemical
CAS: 58-55-9 Molecular Formula: C7H8N4O2 Molecular Weight (g/mol): 180.17 InChI Key: ZFXYFBGIUFBOJW-UHFFFAOYSA-N IUPAC Name: 1,3-dimethyl-2,3,6,7-tetrahydro-1H-purine-2,6-dione SMILES: CN1C2=C(NC=N2)C(=O)N(C)C1=O
| CAS | 58-55-9 |
|---|---|
| Molecular Weight (g/mol) | 180.17 |
| SMILES | CN1C2=C(NC=N2)C(=O)N(C)C1=O |
| IUPAC Name | 1,3-dimethyl-2,3,6,7-tetrahydro-1H-purine-2,6-dione |
| InChI Key | ZFXYFBGIUFBOJW-UHFFFAOYSA-N |
| Molecular Formula | C7H8N4O2 |
Niacin, Powder, USP, 98-102%, Spectrum™ Chemical
CAS: 59-67-6 Molecular Formula: C6H5NO2 Molecular Weight (g/mol): 123.11 MDL Number: MFCD00006391 InChI Key: PVNIIMVLHYAWGP-UHFFFAOYSA-N IUPAC Name: pyridine-3-carboxylic acid SMILES: OC(=O)C1=CC=CN=C1
| CAS | 59-67-6 |
|---|---|
| Molecular Weight (g/mol) | 123.11 |
| MDL Number | MFCD00006391 |
| SMILES | OC(=O)C1=CC=CN=C1 |
| IUPAC Name | pyridine-3-carboxylic acid |
| InChI Key | PVNIIMVLHYAWGP-UHFFFAOYSA-N |
| Molecular Formula | C6H5NO2 |
2-Chloro-3-fluoropyridine, 97%
CAS: 17282-04-1 Molecular Formula: C5H3ClFN Molecular Weight (g/mol): 131.534 MDL Number: MFCD03095302 InChI Key: SVAZIMBLBHOVIR-UHFFFAOYSA-N Synonym: 3-fluoro-2-chloropyridine,2-chloro-3-fluoro pyridine,pyridine, 2-chloro-3-fluoro,2-chloro-3-fluoro-pyridine,pubchem2532,acmc-1cc0d,ksc174s3h,2-chloro-3-fluoropyridine,2-chloro-3-fluoropyridine 1g PubChem CID: 2782791 IUPAC Name: 2-chloro-3-fluoropyridine SMILES: C1=CC(=C(N=C1)Cl)F
| PubChem CID | 2782791 |
|---|---|
| CAS | 17282-04-1 |
| Molecular Weight (g/mol) | 131.534 |
| MDL Number | MFCD03095302 |
| SMILES | C1=CC(=C(N=C1)Cl)F |
| Synonym | 3-fluoro-2-chloropyridine,2-chloro-3-fluoro pyridine,pyridine, 2-chloro-3-fluoro,2-chloro-3-fluoro-pyridine,pubchem2532,acmc-1cc0d,ksc174s3h,2-chloro-3-fluoropyridine,2-chloro-3-fluoropyridine 1g |
| IUPAC Name | 2-chloro-3-fluoropyridine |
| InChI Key | SVAZIMBLBHOVIR-UHFFFAOYSA-N |
| Molecular Formula | C5H3ClFN |
Thiochroman-4-one, 98%
CAS: 3528-17-4 Molecular Formula: C9H8OS Molecular Weight (g/mol): 164.22 MDL Number: MFCD00006882 InChI Key: CVQSWZMJOGOPAV-UHFFFAOYSA-N Synonym: thiochroman-4-one,4h-1-benzothiopyran-4-one, 2,3-dihydro,2,3-dihydro-4h-thiochromen-4-one,3,4-dihydro-2h-1-benzothiopyran-4-one,4h-1-benzothiopyran-4-one,3-dihydro,2,3-dihydro-1-benzothiopyran-4-one,4-thiochromanone,thiochroman-4-on,1-thiochroman-4-one PubChem CID: 19048 IUPAC Name: 2,3-dihydrothiochromen-4-one SMILES: C1CSC2=CC=CC=C2C1=O
| PubChem CID | 19048 |
|---|---|
| CAS | 3528-17-4 |
| Molecular Weight (g/mol) | 164.22 |
| MDL Number | MFCD00006882 |
| SMILES | C1CSC2=CC=CC=C2C1=O |
| Synonym | thiochroman-4-one,4h-1-benzothiopyran-4-one, 2,3-dihydro,2,3-dihydro-4h-thiochromen-4-one,3,4-dihydro-2h-1-benzothiopyran-4-one,4h-1-benzothiopyran-4-one,3-dihydro,2,3-dihydro-1-benzothiopyran-4-one,4-thiochromanone,thiochroman-4-on,1-thiochroman-4-one |
| IUPAC Name | 2,3-dihydrothiochromen-4-one |
| InChI Key | CVQSWZMJOGOPAV-UHFFFAOYSA-N |
| Molecular Formula | C9H8OS |
2-Chloro-4-cyanopyridine, 97%
CAS: 33252-30-1 Molecular Formula: C6H3ClN2 Molecular Weight (g/mol): 138.554 MDL Number: MFCD00174318 InChI Key: QRXBTPFMCTXCRD-UHFFFAOYSA-N Synonym: 2-chloro-4-cyanopyridine,2-chloroisonicotinonitrile,2-chloro-4-pyridinecarbonitrile,2-chloro-isonicotinonitrile,4-cyano-2-chloropyridine,4-pyridinecarbonitrile, 2-chloro,2-chloro-4-cyano pyridine,2-chlorisonicotinonitril,pubchem2582 PubChem CID: 568638 IUPAC Name: 2-chloropyridine-4-carbonitrile SMILES: C1=CN=C(C=C1C#N)Cl
| PubChem CID | 568638 |
|---|---|
| CAS | 33252-30-1 |
| Molecular Weight (g/mol) | 138.554 |
| MDL Number | MFCD00174318 |
| SMILES | C1=CN=C(C=C1C#N)Cl |
| Synonym | 2-chloro-4-cyanopyridine,2-chloroisonicotinonitrile,2-chloro-4-pyridinecarbonitrile,2-chloro-isonicotinonitrile,4-cyano-2-chloropyridine,4-pyridinecarbonitrile, 2-chloro,2-chloro-4-cyano pyridine,2-chlorisonicotinonitril,pubchem2582 |
| IUPAC Name | 2-chloropyridine-4-carbonitrile |
| InChI Key | QRXBTPFMCTXCRD-UHFFFAOYSA-N |
| Molecular Formula | C6H3ClN2 |
Povidone-Iodine, USP, 9-12%, Spectrum™ Chemical
CAS: 25655-41-8 Molecular Formula: (C6H9NO)nI2 Molecular Weight (g/mol): 364.95 MDL Number: MFCD00084483 InChI Key: CPKVUHPKYQGHMW-UHFFFAOYSA-N IUPAC Name: 1-ethenylpyrrolidin-2-one; diiodine SMILES: II.*-CC(-*)N1CCCC1=O
| CAS | 25655-41-8 |
|---|---|
| Molecular Weight (g/mol) | 364.95 |
| MDL Number | MFCD00084483 |
| SMILES | II.*-CC(-*)N1CCCC1=O |
| IUPAC Name | 1-ethenylpyrrolidin-2-one; diiodine |
| InChI Key | CPKVUHPKYQGHMW-UHFFFAOYSA-N |
| Molecular Formula | (C6H9NO)nI2 |
Cetylpyridinium Chloride, Monohydrate, USP, 98-102%, Spectrum™ Chemical
CAS: 6004-24-6 Molecular Formula: C21H40ClNO Molecular Weight (g/mol): 358.01 MDL Number: MFCD00149977 InChI Key: NFCRBQADEGXVDL-UHFFFAOYSA-M IUPAC Name: 1-hexadecyl-1,4-dihydropyridin-4-ylium hydrate chloride SMILES: O.[Cl-].CCCCCCCCCCCCCCCCN1C=C[CH+]C=C1
| CAS | 6004-24-6 |
|---|---|
| Molecular Weight (g/mol) | 358.01 |
| MDL Number | MFCD00149977 |
| SMILES | O.[Cl-].CCCCCCCCCCCCCCCCN1C=C[CH+]C=C1 |
| IUPAC Name | 1-hexadecyl-1,4-dihydropyridin-4-ylium hydrate chloride |
| InChI Key | NFCRBQADEGXVDL-UHFFFAOYSA-M |
| Molecular Formula | C21H40ClNO |
Sorbitan Monostearate, NF, 68-76%, Spectrum™ Chemical
CAS: 1338-41-6 Molecular Formula: C24H46O6 Molecular Weight (g/mol): 430.63 MDL Number: MFCD00005366,MFCD00005366 InChI Key: HVUMOYIDDBPOLL-IIZJTUPISA-N IUPAC Name: 2-[(2R,3S,4R)-3,4-dihydroxyoxolan-2-yl]-2-hydroxyethyl octadecanoate SMILES: CCCCCCCCCCCCCCCCCC(=O)OCC(O)[C@H]1OC[C@@H](O)[C@@H]1O
| CAS | 1338-41-6 |
|---|---|
| Molecular Weight (g/mol) | 430.63 |
| MDL Number | MFCD00005366,MFCD00005366 |
| SMILES | CCCCCCCCCCCCCCCCCC(=O)OCC(O)[C@H]1OC[C@@H](O)[C@@H]1O |
| IUPAC Name | 2-[(2R,3S,4R)-3,4-dihydroxyoxolan-2-yl]-2-hydroxyethyl octadecanoate |
| InChI Key | HVUMOYIDDBPOLL-IIZJTUPISA-N |
| Molecular Formula | C24H46O6 |
3-Methylpyrazole, 99%
CAS: 1453-58-3 Molecular Formula: C4H6N2 Molecular Weight (g/mol): 82.11 MDL Number: MFCD00005240,MFCD08685900 InChI Key: XKVUYEYANWFIJX-UHFFFAOYSA-N 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 |
| IUPAC Name | 5-methyl-1H-pyrazole |
| InChI Key | XKVUYEYANWFIJX-UHFFFAOYSA-N |
| Molecular Formula | C4H6N2 |
2-Hydroxy-5-methylpyridine, 97%
CAS: 91914-06-6 Molecular Formula: C6H7NO Molecular Weight (g/mol): 109.13 MDL Number: MFCD03092888 InChI Key: SOHMZGMHXUQHGE-UHFFFAOYSA-N Synonym: 2-hydroxy-5-methylpyridine,5-methylpyridin-2-ol,2-hydroxy-5-picoline,5-methyl-2-pyridinol,5-methylpyridin-2 1h-one,5-methyl-2-pyridone,5-methyl-2 1h-pyridinone,2 1h-pyridinone, 5-methyl,2-pyridinol, 5-methyl,6-hydroxy-3-picoline PubChem CID: 70482 IUPAC Name: 5-methyl-1H-pyridin-2-one SMILES: CC1=CNC(=O)C=C1
| PubChem CID | 70482 |
|---|---|
| CAS | 91914-06-6 |
| Molecular Weight (g/mol) | 109.13 |
| MDL Number | MFCD03092888 |
| SMILES | CC1=CNC(=O)C=C1 |
| Synonym | 2-hydroxy-5-methylpyridine,5-methylpyridin-2-ol,2-hydroxy-5-picoline,5-methyl-2-pyridinol,5-methylpyridin-2 1h-one,5-methyl-2-pyridone,5-methyl-2 1h-pyridinone,2 1h-pyridinone, 5-methyl,2-pyridinol, 5-methyl,6-hydroxy-3-picoline |
| IUPAC Name | 5-methyl-1H-pyridin-2-one |
| InChI Key | SOHMZGMHXUQHGE-UHFFFAOYSA-N |
| Molecular Formula | C6H7NO |
2,4-Pyridinedicarboxylic acid hydrate, 99+%
CAS: 499-80-9 Molecular Formula: C7H5NO4 Molecular Weight (g/mol): 167.12 MDL Number: MFCD00149413 InChI Key: MJIVRKPEXXHNJT-UHFFFAOYSA-N Synonym: 2,4-pyridinedicarboxylic acid,lutidinic acid,2,4-lutidinic acid,2,4-pyridinedicarboxylicacid, hydrate 1:1,4nrq,pd2,4-carboxypicolinic acid,pubchem16314,pyridine carboxylate, 6a,acmc-1bnb9 PubChem CID: 10365 ChEBI: CHEBI:44737 IUPAC Name: pyridine-2,4-dicarboxylic acid SMILES: OC(=O)C1=CC=NC(=C1)C(O)=O
| PubChem CID | 10365 |
|---|---|
| CAS | 499-80-9 |
| Molecular Weight (g/mol) | 167.12 |
| ChEBI | CHEBI:44737 |
| MDL Number | MFCD00149413 |
| SMILES | OC(=O)C1=CC=NC(=C1)C(O)=O |
| Synonym | 2,4-pyridinedicarboxylic acid,lutidinic acid,2,4-lutidinic acid,2,4-pyridinedicarboxylicacid, hydrate 1:1,4nrq,pd2,4-carboxypicolinic acid,pubchem16314,pyridine carboxylate, 6a,acmc-1bnb9 |
| IUPAC Name | pyridine-2,4-dicarboxylic acid |
| InChI Key | MJIVRKPEXXHNJT-UHFFFAOYSA-N |
| Molecular Formula | C7H5NO4 |