Organoheterocyclic compounds
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Bis(tetraethylammonium) bis(2-thioxo-1,3-dithiole-4,5-dithiolato)zincate, 97%
CAS: 72022-68-5 Molecular Formula: C22H40N2S10Zn Molecular Weight (g/mol): 718.556 MDL Number: MFCD00623815 InChI Key: TXRIVAQWJHZFOT-UHFFFAOYSA-J Synonym: bis tetraethylammonium bis 2-thioxo-1,3-dithiole-4,5-dithiolato zincate PubChem CID: 15762389 IUPAC Name: zinc;2-sulfanylidene-1,3-dithiole-4,5-dithiolate;tetraethylazanium SMILES: CC[N+](CC)(CC)CC.CC[N+](CC)(CC)CC.C1(=C(SC(=S)S1)[S-])[S-].C1(=C(SC(=S)S1)[S-])[S-].[Zn+2]
| PubChem CID | 15762389 |
|---|---|
| CAS | 72022-68-5 |
| Molecular Weight (g/mol) | 718.556 |
| MDL Number | MFCD00623815 |
| SMILES | CC[N+](CC)(CC)CC.CC[N+](CC)(CC)CC.C1(=C(SC(=S)S1)[S-])[S-].C1(=C(SC(=S)S1)[S-])[S-].[Zn+2] |
| Synonym | bis tetraethylammonium bis 2-thioxo-1,3-dithiole-4,5-dithiolato zincate |
| IUPAC Name | zinc;2-sulfanylidene-1,3-dithiole-4,5-dithiolate;tetraethylazanium |
| InChI Key | TXRIVAQWJHZFOT-UHFFFAOYSA-J |
| Molecular Formula | C22H40N2S10Zn |
Biotin, Powder, USP, 97.5-102%, Spectrum™ Chemical
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CAS: 58-85-5 Molecular Formula: C10H16N2O3S Molecular Weight (g/mol): 244.31 MDL Number: MFCD00005541 InChI Key: YBJHBAHKTGYVGT-UHFFFAOYNA-N IUPAC Name: 5-{2-oxo-hexahydro-1H-thieno[3,4-d]imidazol-4-yl}pentanoic acid SMILES: OC(=O)CCCCC1SCC2NC(=O)NC12
| CAS | 58-85-5 |
|---|---|
| Molecular Weight (g/mol) | 244.31 |
| MDL Number | MFCD00005541 |
| SMILES | OC(=O)CCCCC1SCC2NC(=O)NC12 |
| IUPAC Name | 5-{2-oxo-hexahydro-1H-thieno[3,4-d]imidazol-4-yl}pentanoic acid |
| InChI Key | YBJHBAHKTGYVGT-UHFFFAOYNA-N |
| Molecular Formula | C10H16N2O3S |
4,5-Dicyanoimidazole, 99%
CAS: 1122-28-7 Molecular Formula: C5H2N4 Molecular Weight (g/mol): 118.10 MDL Number: MFCD00005194 InChI Key: XGDRLCRGKUCBQL-UHFFFAOYSA-N PubChem CID: 70729 IUPAC Name: 1H-imidazole-4,5-dicarbonitrile SMILES: N#CC1=C(N=CN1)C#N
| PubChem CID | 70729 |
|---|---|
| CAS | 1122-28-7 |
| Molecular Weight (g/mol) | 118.10 |
| MDL Number | MFCD00005194 |
| SMILES | N#CC1=C(N=CN1)C#N |
| IUPAC Name | 1H-imidazole-4,5-dicarbonitrile |
| InChI Key | XGDRLCRGKUCBQL-UHFFFAOYSA-N |
| Molecular Formula | C5H2N4 |
4-(thien-2-ylmethyl)aniline, Thermo Scientific™
CAS: 129136-65-8 Molecular Formula: C11H11NS Molecular Weight (g/mol): 189.276 InChI Key: PIJZLXNJWCKMSA-UHFFFAOYSA-N Synonym: 4-thien-2-ylmethyl aniline,4-thiophen-2-ylmethyl aniline,4-thiophen-2-yl methyl aniline,4-2-thienylmethyl phenylamine PubChem CID: 20063869 IUPAC Name: 4-(thiophen-2-ylmethyl)aniline SMILES: C1=CSC(=C1)CC2=CC=C(C=C2)N
| PubChem CID | 20063869 |
|---|---|
| CAS | 129136-65-8 |
| Molecular Weight (g/mol) | 189.276 |
| SMILES | C1=CSC(=C1)CC2=CC=C(C=C2)N |
| Synonym | 4-thien-2-ylmethyl aniline,4-thiophen-2-ylmethyl aniline,4-thiophen-2-yl methyl aniline,4-2-thienylmethyl phenylamine |
| IUPAC Name | 4-(thiophen-2-ylmethyl)aniline |
| InChI Key | PIJZLXNJWCKMSA-UHFFFAOYSA-N |
| Molecular Formula | C11H11NS |
2-Methylbenzimidazole, 98%
CAS: 615-15-6 Molecular Formula: C8H8N2 Molecular Weight (g/mol): 132.17 MDL Number: MFCD00005598 InChI Key: LDZYRENCLPUXAX-UHFFFAOYSA-N PubChem CID: 11984 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 |
| InChI Key | LDZYRENCLPUXAX-UHFFFAOYSA-N |
| Molecular Formula | C8H8N2 |
Isoquinoline-1-carbonitrile, 99%
CAS: 1198-30-7 Molecular Formula: C10H6N2 Molecular Weight (g/mol): 154.172 MDL Number: MFCD00134166 InChI Key: HJHXYSBRTVFEDD-UHFFFAOYSA-N Synonym: 1-cyanoisoquinoline,1-isoquinolinecarbonitrile,isoquinaldonitrile,isoquinolinecarbonitrile,1-cyano-isoquinoline,isoquinaldinic nitrile,pubchem6269,maybridge1_002114,timtec-bb sbb002487 PubChem CID: 306057 IUPAC Name: isoquinoline-1-carbonitrile SMILES: C1=CC=C2C(=C1)C=CN=C2C#N
| PubChem CID | 306057 |
|---|---|
| CAS | 1198-30-7 |
| Molecular Weight (g/mol) | 154.172 |
| MDL Number | MFCD00134166 |
| SMILES | C1=CC=C2C(=C1)C=CN=C2C#N |
| Synonym | 1-cyanoisoquinoline,1-isoquinolinecarbonitrile,isoquinaldonitrile,isoquinolinecarbonitrile,1-cyano-isoquinoline,isoquinaldinic nitrile,pubchem6269,maybridge1_002114,timtec-bb sbb002487 |
| IUPAC Name | isoquinoline-1-carbonitrile |
| InChI Key | HJHXYSBRTVFEDD-UHFFFAOYSA-N |
| Molecular Formula | C10H6N2 |
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 |
2-n-Pentylpyridine, 98%
CAS: 2294-76-0 Molecular Formula: C10H15N Molecular Weight (g/mol): 149.237 MDL Number: MFCD00051828 InChI Key: HSDXVAOHEOSTFZ-UHFFFAOYSA-N Synonym: 2-amylpyridine,pyridine, 2-pentyl,2-n-pentylpyridine,2-n-amylpyridine,pyridine, pentyl,unii-9n74l1ud11,2-amyl pyridine,2-pentyl pyridine,2-pentyl-pyridine,acmc-1cmx8 PubChem CID: 16800 IUPAC Name: 2-pentylpyridine SMILES: CCCCCC1=CC=CC=N1
| PubChem CID | 16800 |
|---|---|
| CAS | 2294-76-0 |
| Molecular Weight (g/mol) | 149.237 |
| MDL Number | MFCD00051828 |
| SMILES | CCCCCC1=CC=CC=N1 |
| Synonym | 2-amylpyridine,pyridine, 2-pentyl,2-n-pentylpyridine,2-n-amylpyridine,pyridine, pentyl,unii-9n74l1ud11,2-amyl pyridine,2-pentyl pyridine,2-pentyl-pyridine,acmc-1cmx8 |
| IUPAC Name | 2-pentylpyridine |
| InChI Key | HSDXVAOHEOSTFZ-UHFFFAOYSA-N |
| Molecular Formula | C10H15N |
2-Cyanopyridine, 99%
CAS: 100-70-9 Molecular Formula: C6H4N2 Molecular Weight (g/mol): 104.112 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) | 104.112 |
| 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 |
5-Methyl-2-(trifluoromethyl)-3-furyl isocyanate, 97%, Thermo Scientific™
CAS: 306935-03-5 Molecular Formula: C7H4F3NO2 Molecular Weight (g/mol): 191.109 InChI Key: WTKWFNIIIXNTDO-UHFFFAOYSA-N Synonym: 5-methyl-2-trifluoromethyl-3-furyl isocyanate,3-isocyanato-5-methyl-2-trifluoromethyl furan,furan,3-isocyanato-5-methyl-2-trifluoromethyl,5-methyl-2-trifluoromethyl fur-3-yl isocyanate,3-isocyanato-5-methyl-2-trifluoromethyl-furan,5-methyl-2-trifluoromethyl-3-furylisocyanate,5-methyl-2-trifluoromethyl furan-3-isocyanate,furan, 3-isocyanato-5-methyl-2-trifluoromethyl-9ci PubChem CID: 2779896 IUPAC Name: 3-isocyanato-5-methyl-2-(trifluoromethyl)furan SMILES: CC1=CC(=C(O1)C(F)(F)F)N=C=O
| PubChem CID | 2779896 |
|---|---|
| CAS | 306935-03-5 |
| Molecular Weight (g/mol) | 191.109 |
| SMILES | CC1=CC(=C(O1)C(F)(F)F)N=C=O |
| Synonym | 5-methyl-2-trifluoromethyl-3-furyl isocyanate,3-isocyanato-5-methyl-2-trifluoromethyl furan,furan,3-isocyanato-5-methyl-2-trifluoromethyl,5-methyl-2-trifluoromethyl fur-3-yl isocyanate,3-isocyanato-5-methyl-2-trifluoromethyl-furan,5-methyl-2-trifluoromethyl-3-furylisocyanate,5-methyl-2-trifluoromethyl furan-3-isocyanate,furan, 3-isocyanato-5-methyl-2-trifluoromethyl-9ci |
| IUPAC Name | 3-isocyanato-5-methyl-2-(trifluoromethyl)furan |
| InChI Key | WTKWFNIIIXNTDO-UHFFFAOYSA-N |
| Molecular Formula | C7H4F3NO2 |
3-Thien-2-ylbenzonitrile 97+%, Thermo Scientific™
CAS: 380626-35-7 Molecular Formula: C11H7NS Molecular Weight (g/mol): 185.24 MDL Number: MFCD02323389 InChI Key: DIILPQRSOQWSCU-UHFFFAOYSA-N Synonym: 3-thien-2-ylbenzonitrile,3-thiophen-2-yl benzonitrile,3-2-thienyl benzonitrile,3-thiophen-2-yl-benzonitrile,3-2-thienyl benzenecarbonitrile PubChem CID: 4645033 IUPAC Name: 3-thiophen-2-ylbenzonitrile SMILES: N#CC1=CC(=CC=C1)C1=CC=CS1
| PubChem CID | 4645033 |
|---|---|
| CAS | 380626-35-7 |
| Molecular Weight (g/mol) | 185.24 |
| MDL Number | MFCD02323389 |
| SMILES | N#CC1=CC(=CC=C1)C1=CC=CS1 |
| Synonym | 3-thien-2-ylbenzonitrile,3-thiophen-2-yl benzonitrile,3-2-thienyl benzonitrile,3-thiophen-2-yl-benzonitrile,3-2-thienyl benzenecarbonitrile |
| IUPAC Name | 3-thiophen-2-ylbenzonitrile |
| InChI Key | DIILPQRSOQWSCU-UHFFFAOYSA-N |
| Molecular Formula | C11H7NS |
2,7-Dibromocarbazole
CAS: 136630-39-2 Molecular Formula: C12H7Br2N Molecular Weight (g/mol): 325.00 InChI Key: QPTWWBLGJZWRAV-UHFFFAOYSA-N IUPAC Name: 2,7-dibromo-9H-carbazole SMILES: BrC1=CC2=C(C=C1)C1=C(N2)C=C(Br)C=C1
| CAS | 136630-39-2 |
|---|---|
| Molecular Weight (g/mol) | 325.00 |
| SMILES | BrC1=CC2=C(C=C1)C1=C(N2)C=C(Br)C=C1 |
| IUPAC Name | 2,7-dibromo-9H-carbazole |
| InChI Key | QPTWWBLGJZWRAV-UHFFFAOYSA-N |
| Molecular Formula | C12H7Br2N |
2-Ethyl-4-methylimidazole, 96%
CAS: 931-36-2 Molecular Formula: C6H10N2 Molecular Weight (g/mol): 110.16 MDL Number: MFCD00005193 InChI Key: ULKLGIFJWFIQFF-UHFFFAOYSA-N Synonym: 2-ethyl-4-methylimidazole,2-ethyl-4-methyl-1h-imidazole,1h-imidazole, 2-ethyl-4-methyl,4-methyl-2-ethylimidazole,1h-imidazole, 2-ethyl-5-methyl,imidazole, 2-ethyl-4-methyl,unii-5k8xi641g3,2-ethyl-4-methyl-imidazole,2-ethyl-4-methyl-3h-imidazole,curazol 2e4mz PubChem CID: 70262 IUPAC Name: 2-ethyl-5-methyl-1H-imidazole SMILES: CCC1=NC=C(N1)C
| PubChem CID | 70262 |
|---|---|
| CAS | 931-36-2 |
| Molecular Weight (g/mol) | 110.16 |
| MDL Number | MFCD00005193 |
| SMILES | CCC1=NC=C(N1)C |
| Synonym | 2-ethyl-4-methylimidazole,2-ethyl-4-methyl-1h-imidazole,1h-imidazole, 2-ethyl-4-methyl,4-methyl-2-ethylimidazole,1h-imidazole, 2-ethyl-5-methyl,imidazole, 2-ethyl-4-methyl,unii-5k8xi641g3,2-ethyl-4-methyl-imidazole,2-ethyl-4-methyl-3h-imidazole,curazol 2e4mz |
| IUPAC Name | 2-ethyl-5-methyl-1H-imidazole |
| InChI Key | ULKLGIFJWFIQFF-UHFFFAOYSA-N |
| Molecular Formula | C6H10N2 |
4-Cyanopyridine, 98%
CAS: 100-48-1 Molecular Formula: C6H4N2 Molecular Weight (g/mol): 104.11 MDL Number: MFCD00006417 InChI Key: GPHQHTOMRSGBNZ-UHFFFAOYSA-N Synonym: 4-cyanopyridine,isonicotinonitrile,4-pyridinecarbonitrile,isonicotinic acid nitrile,4-pyridinenitrile,4-cyano pyridine,.gamma.-cyanopyridine,gamma-cyanopyridine,p-cyanopyridine,pubchem11155 PubChem CID: 7506 ChEBI: CHEBI:28020 IUPAC Name: pyridine-4-carbonitrile SMILES: C1=CN=CC=C1C#N
| PubChem CID | 7506 |
|---|---|
| CAS | 100-48-1 |
| Molecular Weight (g/mol) | 104.11 |
| ChEBI | CHEBI:28020 |
| MDL Number | MFCD00006417 |
| SMILES | C1=CN=CC=C1C#N |
| Synonym | 4-cyanopyridine,isonicotinonitrile,4-pyridinecarbonitrile,isonicotinic acid nitrile,4-pyridinenitrile,4-cyano pyridine,.gamma.-cyanopyridine,gamma-cyanopyridine,p-cyanopyridine,pubchem11155 |
| IUPAC Name | pyridine-4-carbonitrile |
| InChI Key | GPHQHTOMRSGBNZ-UHFFFAOYSA-N |
| Molecular Formula | C6H4N2 |
Phenazine, 98%
CAS: 92-82-0 Molecular Formula: C12H8N2 Molecular Weight (g/mol): 180.21 MDL Number: MFCD00005023 InChI Key: PCNDJXKNXGMECE-UHFFFAOYSA-N Synonym: dibenzopyrazine,azophenylene,dibenzoparadiazine,acridizine,9,10-diazaanthracene,dibenzo-p-diazine,unii-2jhr6k463w,phenazine,dibenzo b,e pyrazine,acmc-209rhs PubChem CID: 4757 ChEBI: CHEBI:36674 IUPAC Name: phenazine SMILES: C1=CC=C2C(=C1)N=C3C=CC=CC3=N2
| PubChem CID | 4757 |
|---|---|
| CAS | 92-82-0 |
| Molecular Weight (g/mol) | 180.21 |
| ChEBI | CHEBI:36674 |
| MDL Number | MFCD00005023 |
| SMILES | C1=CC=C2C(=C1)N=C3C=CC=CC3=N2 |
| Synonym | dibenzopyrazine,azophenylene,dibenzoparadiazine,acridizine,9,10-diazaanthracene,dibenzo-p-diazine,unii-2jhr6k463w,phenazine,dibenzo b,e pyrazine,acmc-209rhs |
| IUPAC Name | phenazine |
| InChI Key | PCNDJXKNXGMECE-UHFFFAOYSA-N |
| Molecular Formula | C12H8N2 |