Azoles
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2-(4-Chlorophenyl)benzimidazole 98.0+%, TCI America™
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CAS: 1019-85-8 Molecular Formula: C13H9ClN2 Molecular Weight (g/mol): 228.679 InChI Key: PTXUJRTVWRYYTE-UHFFFAOYSA-N Synonym: 2-4-chlorophenyl benzimidazole,2-4-chlorophenyl-1h-benzoimidazole,2-4-chlorophenyl-1h-benzimidazole,2-4-chloro-phenyl-1h-benzoimidazole,1h-benzimidazole, 2-4-chlorophenyl,2-4-chlorophenyl-1h-benzo d imidazole,2-4-chlorophenyl-1h-1,3-benzodiazole,acmc-2097xz,1h-benzimidazole,2-4-chlorophenyl PubChem CID: 759417 IUPAC Name: 2-(4-chlorophenyl)-1H-benzimidazole SMILES: C1=CC=C2C(=C1)NC(=N2)C3=CC=C(C=C3)Cl
| PubChem CID | 759417 |
|---|---|
| CAS | 1019-85-8 |
| Molecular Weight (g/mol) | 228.679 |
| SMILES | C1=CC=C2C(=C1)NC(=N2)C3=CC=C(C=C3)Cl |
| Synonym | 2-4-chlorophenyl benzimidazole,2-4-chlorophenyl-1h-benzoimidazole,2-4-chlorophenyl-1h-benzimidazole,2-4-chloro-phenyl-1h-benzoimidazole,1h-benzimidazole, 2-4-chlorophenyl,2-4-chlorophenyl-1h-benzo d imidazole,2-4-chlorophenyl-1h-1,3-benzodiazole,acmc-2097xz,1h-benzimidazole,2-4-chlorophenyl |
| IUPAC Name | 2-(4-chlorophenyl)-1H-benzimidazole |
| InChI Key | PTXUJRTVWRYYTE-UHFFFAOYSA-N |
| Molecular Formula | C13H9ClN2 |
1,2-Dimethyl-5-nitroimidazole 97.0+%, TCI America™
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CAS: 551-92-8 Molecular Formula: C5H7N3O2 Molecular Weight (g/mol): 141.13 MDL Number: MFCD00047046 InChI Key: IBXPYPUJPLLOIN-UHFFFAOYSA-N Synonym: dimetridazole,1,2-dimethyl-5-nitro-1h-imidazole,dimetridazol,emtrylvet,emtrymix,emtryl,unizole soluble,1h-imidazole, 1,2-dimethyl-5-nitro,5-nitro-1,2-dimethylimidazole,dimetridazolo PubChem CID: 3090 IUPAC Name: 1,2-dimethyl-5-nitro-1H-imidazole SMILES: CN1C(C)=NC=C1[N+]([O-])=O
| PubChem CID | 3090 |
|---|---|
| CAS | 551-92-8 |
| Molecular Weight (g/mol) | 141.13 |
| MDL Number | MFCD00047046 |
| SMILES | CN1C(C)=NC=C1[N+]([O-])=O |
| Synonym | dimetridazole,1,2-dimethyl-5-nitro-1h-imidazole,dimetridazol,emtrylvet,emtrymix,emtryl,unizole soluble,1h-imidazole, 1,2-dimethyl-5-nitro,5-nitro-1,2-dimethylimidazole,dimetridazolo |
| IUPAC Name | 1,2-dimethyl-5-nitro-1H-imidazole |
| InChI Key | IBXPYPUJPLLOIN-UHFFFAOYSA-N |
| Molecular Formula | C5H7N3O2 |
1-Methyl-3-propylimidazolium Tetrafluoroborate 98.0+%, TCI America™
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CAS: 244193-48-4 Molecular Formula: C7H13BF4N2 Molecular Weight (g/mol): 211.999 MDL Number: MFCD14156016 InChI Key: XFTQQJUVYZPNRC-UHFFFAOYSA-N PubChem CID: 11171853 IUPAC Name: 1-methyl-3-propylimidazol-1-ium;tetrafluoroborate SMILES: [B-](F)(F)(F)F.CCCN1C=C[N+](=C1)C
| PubChem CID | 11171853 |
|---|---|
| CAS | 244193-48-4 |
| Molecular Weight (g/mol) | 211.999 |
| MDL Number | MFCD14156016 |
| SMILES | [B-](F)(F)(F)F.CCCN1C=C[N+](=C1)C |
| IUPAC Name | 1-methyl-3-propylimidazol-1-ium;tetrafluoroborate |
| InChI Key | XFTQQJUVYZPNRC-UHFFFAOYSA-N |
| Molecular Formula | C7H13BF4N2 |
1-(Chloromethyl)-1H-benzotriazole 98.0+%, TCI America™
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CAS: 54187-96-1 Molecular Formula: C7H6ClN3 Molecular Weight (g/mol): 167.60 MDL Number: MFCD00216649 InChI Key: VSEROABGEVRIRY-UHFFFAOYSA-N PubChem CID: 3328222 IUPAC Name: 1-(chloromethyl)-1H-1,2,3-benzotriazole SMILES: ClCN1N=NC2=CC=CC=C12
| PubChem CID | 3328222 |
|---|---|
| CAS | 54187-96-1 |
| Molecular Weight (g/mol) | 167.60 |
| MDL Number | MFCD00216649 |
| SMILES | ClCN1N=NC2=CC=CC=C12 |
| IUPAC Name | 1-(chloromethyl)-1H-1,2,3-benzotriazole |
| InChI Key | VSEROABGEVRIRY-UHFFFAOYSA-N |
| Molecular Formula | C7H6ClN3 |
2-Amino-5-nitrothiazole 98.0+%, TCI America™
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CAS: 121-66-4 Molecular Formula: C3H3N3O2S Molecular Weight (g/mol): 145.14 MDL Number: MFCD00005326 InChI Key: MIHADVKEHAFNPG-UHFFFAOYSA-N Synonym: 2-amino-5-nitrothiazole,5-nitrothiazol-2-amine,enheptin,entramin,2-thiazolamine, 5-nitro,nitramin ido,amnizol soluble,enheptin-t,5-nitro-2-thiazolamine,enheptin premix PubChem CID: 8486 ChEBI: CHEBI:82386 IUPAC Name: 5-nitro-1,3-thiazol-2-amine SMILES: NC1=NC=C(S1)[N+]([O-])=O
| PubChem CID | 8486 |
|---|---|
| CAS | 121-66-4 |
| Molecular Weight (g/mol) | 145.14 |
| ChEBI | CHEBI:82386 |
| MDL Number | MFCD00005326 |
| SMILES | NC1=NC=C(S1)[N+]([O-])=O |
| Synonym | 2-amino-5-nitrothiazole,5-nitrothiazol-2-amine,enheptin,entramin,2-thiazolamine, 5-nitro,nitramin ido,amnizol soluble,enheptin-t,5-nitro-2-thiazolamine,enheptin premix |
| IUPAC Name | 5-nitro-1,3-thiazol-2-amine |
| InChI Key | MIHADVKEHAFNPG-UHFFFAOYSA-N |
| Molecular Formula | C3H3N3O2S |
Indazole 99.0+%, TCI America™
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CAS: 271-44-3 Molecular Formula: C7H6N2 Molecular Weight (g/mol): 118.139 MDL Number: MFCD00005691 InChI Key: BAXOFTOLAUCFNW-UHFFFAOYSA-N Synonym: indazole,1h-benzopyrazole,2-azaindole,isoindazole,2h-indazole,1,2-diazaindene,1,2-benzodiazole,1h-indazol,benzopyrazole,1,2-benzopyrazole PubChem CID: 9221 ChEBI: CHEBI:36669 IUPAC Name: 1H-indazole SMILES: C1=CC=C2C(=C1)C=NN2
| PubChem CID | 9221 |
|---|---|
| CAS | 271-44-3 |
| Molecular Weight (g/mol) | 118.139 |
| ChEBI | CHEBI:36669 |
| MDL Number | MFCD00005691 |
| SMILES | C1=CC=C2C(=C1)C=NN2 |
| Synonym | indazole,1h-benzopyrazole,2-azaindole,isoindazole,2h-indazole,1,2-diazaindene,1,2-benzodiazole,1h-indazol,benzopyrazole,1,2-benzopyrazole |
| IUPAC Name | 1H-indazole |
| InChI Key | BAXOFTOLAUCFNW-UHFFFAOYSA-N |
| Molecular Formula | C7H6N2 |
1-Ethyl-2,3-dimethylimidazolium Bis(trifluoromethanesulfonyl)imide 98.0+%, TCI America™
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CAS: 174899-90-2 Molecular Formula: C9H13F6N3O4S2 Molecular Weight (g/mol): 405.33 InChI Key: XDJYSDBSJWNTQT-UHFFFAOYSA-N PubChem CID: 21932259 IUPAC Name: bis(trifluoromethylsulfonyl)azanide;1-ethyl-2,3-dimethylimidazol-3-ium SMILES: CCN1C=C[N+](=C1C)C.C(F)(F)(F)S(=O)(=O)[N-]S(=O)(=O)C(F)(F)F
| PubChem CID | 21932259 |
|---|---|
| CAS | 174899-90-2 |
| Molecular Weight (g/mol) | 405.33 |
| SMILES | CCN1C=C[N+](=C1C)C.C(F)(F)(F)S(=O)(=O)[N-]S(=O)(=O)C(F)(F)F |
| IUPAC Name | bis(trifluoromethylsulfonyl)azanide;1-ethyl-2,3-dimethylimidazol-3-ium |
| InChI Key | XDJYSDBSJWNTQT-UHFFFAOYSA-N |
| Molecular Formula | C9H13F6N3O4S2 |
1-Ethyl-3-methylimidazolium Thiocyanate 98.0+%, TCI America™
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CAS: 331717-63-6 Molecular Formula: C7H11N3S Molecular Weight (g/mol): 169.246 MDL Number: MFCD06798182 InChI Key: VASPYXGQVWPGAB-UHFFFAOYSA-M Synonym: 1-ethyl-3-methylimidazolium thiocyanate,basionics™ vs 01,dsstox_cid_27860,dsstox_rid_82613,dsstox_gsid_47884,1-methyl-3-ethylimidazolium thiocyanate,1-ethyl-3-methyl imidazolium thio-cyanate,1-ethyl-3-methyl-1h-imidazol-3-ium thiocyanate,1-ethyl-3-methylimidazolium thiocyanate h-nmr, hplc,1-ethyl-3-methylimidazolium thiocyanate, for electrochemistry t PubChem CID: 16211115 IUPAC Name: 1-ethyl-3-methylimidazol-3-ium;thiocyanate SMILES: CCN1C=C[N+](=C1)C.C(#N)[S-]
| PubChem CID | 16211115 |
|---|---|
| CAS | 331717-63-6 |
| Molecular Weight (g/mol) | 169.246 |
| MDL Number | MFCD06798182 |
| SMILES | CCN1C=C[N+](=C1)C.C(#N)[S-] |
| Synonym | 1-ethyl-3-methylimidazolium thiocyanate,basionics™ vs 01,dsstox_cid_27860,dsstox_rid_82613,dsstox_gsid_47884,1-methyl-3-ethylimidazolium thiocyanate,1-ethyl-3-methyl imidazolium thio-cyanate,1-ethyl-3-methyl-1h-imidazol-3-ium thiocyanate,1-ethyl-3-methylimidazolium thiocyanate h-nmr, hplc,1-ethyl-3-methylimidazolium thiocyanate, for electrochemistry t |
| IUPAC Name | 1-ethyl-3-methylimidazol-3-ium;thiocyanate |
| InChI Key | VASPYXGQVWPGAB-UHFFFAOYSA-M |
| Molecular Formula | C7H11N3S |
1-(2-Cyanoethyl)-2-phenylimidazole 98.0+%, TCI America™
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CAS: 23996-12-5 Molecular Formula: C12H11N3 Molecular Weight (g/mol): 197.24 MDL Number: MFCD00047047 InChI Key: BVYPJEBKDLFIDL-UHFFFAOYSA-N Synonym: 1-2-cyanoethyl-2-phenylimidazole,3-2-phenyl-1h-imidazol-1-yl propanenitrile,1h-imidazole-1-propanenitrile, 2-phenyl,2-phenyl-1h-imidazole-1-propiononitrile,3-2-phenylimidazol-1-yl propanenitrile,1h-imidazole-1-propanenitrile,2-phenyl,3-2-phenyl-imidazol-1-yl-propionitrile,acmc-1cmrx,2-phenyl-1h-imidazole-1-propanenitrile,3-2-phenyl-1-imidazolyl propionitrile PubChem CID: 90325 IUPAC Name: 3-(2-phenyl-1H-imidazol-1-yl)propanenitrile SMILES: N#CCCN1C=CN=C1C1=CC=CC=C1
| PubChem CID | 90325 |
|---|---|
| CAS | 23996-12-5 |
| Molecular Weight (g/mol) | 197.24 |
| MDL Number | MFCD00047047 |
| SMILES | N#CCCN1C=CN=C1C1=CC=CC=C1 |
| Synonym | 1-2-cyanoethyl-2-phenylimidazole,3-2-phenyl-1h-imidazol-1-yl propanenitrile,1h-imidazole-1-propanenitrile, 2-phenyl,2-phenyl-1h-imidazole-1-propiononitrile,3-2-phenylimidazol-1-yl propanenitrile,1h-imidazole-1-propanenitrile,2-phenyl,3-2-phenyl-imidazol-1-yl-propionitrile,acmc-1cmrx,2-phenyl-1h-imidazole-1-propanenitrile,3-2-phenyl-1-imidazolyl propionitrile |
| IUPAC Name | 3-(2-phenyl-1H-imidazol-1-yl)propanenitrile |
| InChI Key | BVYPJEBKDLFIDL-UHFFFAOYSA-N |
| Molecular Formula | C12H11N3 |
6-Bromoindazole 98.0+%, TCI America™
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CAS: 79762-54-2 Molecular Formula: C7H5BrN2 Molecular Weight (g/mol): 197.04 MDL Number: MFCD03265457 InChI Key: WMKDUJVLNZANRN-UHFFFAOYSA-N PubChem CID: 17842471 IUPAC Name: 6-bromo-1H-indazole SMILES: BrC1=CC=C2C=NNC2=C1
| PubChem CID | 17842471 |
|---|---|
| CAS | 79762-54-2 |
| Molecular Weight (g/mol) | 197.04 |
| MDL Number | MFCD03265457 |
| SMILES | BrC1=CC=C2C=NNC2=C1 |
| IUPAC Name | 6-bromo-1H-indazole |
| InChI Key | WMKDUJVLNZANRN-UHFFFAOYSA-N |
| Molecular Formula | C7H5BrN2 |
1-Butyl-2,3-dimethylimidazolium Hexafluorophosphate 97.0+%, TCI America™
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CAS: 227617-70-1 Molecular Formula: C9H17F6N2P Molecular Weight (g/mol): 298.21 MDL Number: MFCD03790877 InChI Key: JWFPQAXAGSAKRF-UHFFFAOYSA-N Synonym: 1-butyl-2,3-dimethylimidazolium hexafluorophosphate,1-butyl-2,3-dimethyl-1h-imidazol-3-ium hexafluorophosphate v,1-butyl-2,3-dimethylimidazol-1-ium hexafluorophosphate,3-butyl-1,2-dimethylimidazol-1-ium hexafluorophosphate,acmc-209fyn,bdmim pf6,c4c1mim pf6,c4mmim pf6,dsstox_cid_27883,dsstox_rid_82636 PubChem CID: 11243457 IUPAC Name: 1-butyl-2,3-dimethyl-1H-imidazol-3-ium; hexafluoro-λ⁵-phosphanuide SMILES: F[P-](F)(F)(F)(F)F.CCCCN1C=C[N+](C)=C1C
| PubChem CID | 11243457 |
|---|---|
| CAS | 227617-70-1 |
| Molecular Weight (g/mol) | 298.21 |
| MDL Number | MFCD03790877 |
| SMILES | F[P-](F)(F)(F)(F)F.CCCCN1C=C[N+](C)=C1C |
| Synonym | 1-butyl-2,3-dimethylimidazolium hexafluorophosphate,1-butyl-2,3-dimethyl-1h-imidazol-3-ium hexafluorophosphate v,1-butyl-2,3-dimethylimidazol-1-ium hexafluorophosphate,3-butyl-1,2-dimethylimidazol-1-ium hexafluorophosphate,acmc-209fyn,bdmim pf6,c4c1mim pf6,c4mmim pf6,dsstox_cid_27883,dsstox_rid_82636 |
| IUPAC Name | 1-butyl-2,3-dimethyl-1H-imidazol-3-ium; hexafluoro-λ⁵-phosphanuide |
| InChI Key | JWFPQAXAGSAKRF-UHFFFAOYSA-N |
| Molecular Formula | C9H17F6N2P |
2-Ethyl-4,5-dimethylthiazole 98.0+%, TCI America™
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CAS: 873-64-3 Molecular Formula: C7H11NS Molecular Weight (g/mol): 141.232 MDL Number: MFCD00053125 InChI Key: BVOKJOZBJOWZNJ-UHFFFAOYSA-N PubChem CID: 522877 IUPAC Name: 2-ethyl-4,5-dimethyl-1,3-thiazole SMILES: CCC1=NC(=C(S1)C)C
| PubChem CID | 522877 |
|---|---|
| CAS | 873-64-3 |
| Molecular Weight (g/mol) | 141.232 |
| MDL Number | MFCD00053125 |
| SMILES | CCC1=NC(=C(S1)C)C |
| IUPAC Name | 2-ethyl-4,5-dimethyl-1,3-thiazole |
| InChI Key | BVOKJOZBJOWZNJ-UHFFFAOYSA-N |
| Molecular Formula | C7H11NS |
1,3-Dimesitylimidazol-2-ylidene 97.0+%, TCI America™
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CAS: 141556-42-5 Molecular Formula: C21H24N2 Molecular Weight (g/mol): 304.437 MDL Number: MFCD09265338 InChI Key: JCYWCSGERIELPG-UHFFFAOYSA-N Synonym: IMes PubChem CID: 11123757 IUPAC Name: 1,3-bis(2,4,6-trimethylphenyl)-2H-imidazol-1-ium-2-ide SMILES: CC1=CC(=C(C(=C1)C)N2C=C[N+](=[C-]2)C3=C(C=C(C=C3C)C)C)C
| PubChem CID | 11123757 |
|---|---|
| CAS | 141556-42-5 |
| Molecular Weight (g/mol) | 304.437 |
| MDL Number | MFCD09265338 |
| SMILES | CC1=CC(=C(C(=C1)C)N2C=C[N+](=[C-]2)C3=C(C=C(C=C3C)C)C)C |
| Synonym | IMes |
| IUPAC Name | 1,3-bis(2,4,6-trimethylphenyl)-2H-imidazol-1-ium-2-ide |
| InChI Key | JCYWCSGERIELPG-UHFFFAOYSA-N |
| Molecular Formula | C21H24N2 |
4-(Chloromethyl)-3,5-dimethylisoxazole 95.0+%, TCI America™
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CAS: 19788-37-5 Molecular Formula: C6H8ClNO Molecular Weight (g/mol): 145.586 MDL Number: MFCD00003154 InChI Key: NIFAUKBQIAURIM-UHFFFAOYSA-N Synonym: 4-chloromethyl-3,5-dimethylisoxazole,isoxazole, 4-chloromethyl-3,5-dimethyl,4-chloromethyl-3,5-dimethyl-1,2-oxazole,4-chloromethyl-3,5-dimethyl-isoxazole,3,5-dimethyl-4-chloromethylisoxazole,4-chloromethyl-3,5-dimethyl isoxazole,pubchem8667,acmc-1c8qy,akos bc-3064 PubChem CID: 88246 IUPAC Name: 4-(chloromethyl)-3,5-dimethyl-1,2-oxazole SMILES: CC1=C(C(=NO1)C)CCl
| PubChem CID | 88246 |
|---|---|
| CAS | 19788-37-5 |
| Molecular Weight (g/mol) | 145.586 |
| MDL Number | MFCD00003154 |
| SMILES | CC1=C(C(=NO1)C)CCl |
| Synonym | 4-chloromethyl-3,5-dimethylisoxazole,isoxazole, 4-chloromethyl-3,5-dimethyl,4-chloromethyl-3,5-dimethyl-1,2-oxazole,4-chloromethyl-3,5-dimethyl-isoxazole,3,5-dimethyl-4-chloromethylisoxazole,4-chloromethyl-3,5-dimethyl isoxazole,pubchem8667,acmc-1c8qy,akos bc-3064 |
| IUPAC Name | 4-(chloromethyl)-3,5-dimethyl-1,2-oxazole |
| InChI Key | NIFAUKBQIAURIM-UHFFFAOYSA-N |
| Molecular Formula | C6H8ClNO |
3-Mercapto-4-methyl-4H-1,2,4-triazole 98.0+%, TCI America™
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