Azoles
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1-Phenylimidazole 98.0+%, TCI America™
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CAS: 7164-98-9 Molecular Formula: C9H8N2 Molecular Weight (g/mol): 144.18 MDL Number: MFCD00041204 InChI Key: SEULWJSKCVACTH-UHFFFAOYSA-N Synonym: 1-phenyl-1h-imidazole,phenylimidazole,n-phenylimidazole,1h-imidazole, 1-phenyl,1h-imidazole, phenyl,n-phenyl imidazole,pubchem12611,acmc-20aos8,1-phenylimidazole,1-phenyl-1h-imidazole # PubChem CID: 81595 IUPAC Name: 1-phenyl-1H-imidazole SMILES: C1=CN(C=N1)C1=CC=CC=C1
| PubChem CID | 81595 |
|---|---|
| CAS | 7164-98-9 |
| Molecular Weight (g/mol) | 144.18 |
| MDL Number | MFCD00041204 |
| SMILES | C1=CN(C=N1)C1=CC=CC=C1 |
| Synonym | 1-phenyl-1h-imidazole,phenylimidazole,n-phenylimidazole,1h-imidazole, 1-phenyl,1h-imidazole, phenyl,n-phenyl imidazole,pubchem12611,acmc-20aos8,1-phenylimidazole,1-phenyl-1h-imidazole # |
| IUPAC Name | 1-phenyl-1H-imidazole |
| InChI Key | SEULWJSKCVACTH-UHFFFAOYSA-N |
| Molecular Formula | C9H8N2 |
5-Benzotriazolecarboxylic Acid 96.0+%, TCI America™
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CAS: 23814-12-2 Molecular Formula: C7H5N3O2 Molecular Weight (g/mol): 163.136 MDL Number: MFCD00012318 InChI Key: GUOVBFFLXKJFEE-UHFFFAOYSA-N Synonym: 5-Carboxybenzotriazole PubChem CID: 72917 IUPAC Name: 2H-benzotriazole-5-carboxylic acid SMILES: C1=CC2=NNN=C2C=C1C(=O)O
| PubChem CID | 72917 |
|---|---|
| CAS | 23814-12-2 |
| Molecular Weight (g/mol) | 163.136 |
| MDL Number | MFCD00012318 |
| SMILES | C1=CC2=NNN=C2C=C1C(=O)O |
| Synonym | 5-Carboxybenzotriazole |
| IUPAC Name | 2H-benzotriazole-5-carboxylic acid |
| InChI Key | GUOVBFFLXKJFEE-UHFFFAOYSA-N |
| Molecular Formula | C7H5N3O2 |
3-(Trifluoromethyl)pyrazole 98.0+%, TCI America™
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CAS: 20154-03-4 Molecular Formula: C4H3F3N2 Molecular Weight (g/mol): 136.077 MDL Number: MFCD00115018 InChI Key: PYXNITNKYBLBMW-UHFFFAOYSA-N Synonym: 3-trifluoromethyl pyrazole,3-trifluoromethyl-1h-pyrazole,5-trifluoromethyl-1h-pyrazole,3-trifluoromethylpyrazole,trifluoromethylpyrazole,1h-pyrazole, 3-trifluoromethyl,3-trifluoromethyl-2h-pyrazole,pubchem10164,pubchem10423 PubChem CID: 1807034 IUPAC Name: 5-(trifluoromethyl)-1H-pyrazole SMILES: C1=C(NN=C1)C(F)(F)F
| PubChem CID | 1807034 |
|---|---|
| CAS | 20154-03-4 |
| Molecular Weight (g/mol) | 136.077 |
| MDL Number | MFCD00115018 |
| SMILES | C1=C(NN=C1)C(F)(F)F |
| Synonym | 3-trifluoromethyl pyrazole,3-trifluoromethyl-1h-pyrazole,5-trifluoromethyl-1h-pyrazole,3-trifluoromethylpyrazole,trifluoromethylpyrazole,1h-pyrazole, 3-trifluoromethyl,3-trifluoromethyl-2h-pyrazole,pubchem10164,pubchem10423 |
| IUPAC Name | 5-(trifluoromethyl)-1H-pyrazole |
| InChI Key | PYXNITNKYBLBMW-UHFFFAOYSA-N |
| Molecular Formula | C4H3F3N2 |
5-Phenylisoxazole 98.0+%, TCI America™
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CAS: 1006-67-3 Molecular Formula: C9H7NO Molecular Weight (g/mol): 145.161 MDL Number: MFCD00090038 InChI Key: BXQDLEHCXQQSCH-UHFFFAOYSA-N PubChem CID: 136800 IUPAC Name: 5-phenyl-1,2-oxazole SMILES: C1=CC=C(C=C1)C2=CC=NO2
| PubChem CID | 136800 |
|---|---|
| CAS | 1006-67-3 |
| Molecular Weight (g/mol) | 145.161 |
| MDL Number | MFCD00090038 |
| SMILES | C1=CC=C(C=C1)C2=CC=NO2 |
| IUPAC Name | 5-phenyl-1,2-oxazole |
| InChI Key | BXQDLEHCXQQSCH-UHFFFAOYSA-N |
| Molecular Formula | C9H7NO |
2-Methylthiazole-5-carboxylic Acid 98.0+%, TCI America™
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CAS: 40004-69-1 Molecular Formula: C5H5NO2S Molecular Weight (g/mol): 143.16 MDL Number: MFCD01760300 InChI Key: QCXCIYPOMMIBHO-UHFFFAOYSA-N PubChem CID: 98845 IUPAC Name: 2-methyl-1,3-thiazole-5-carboxylic acid SMILES: CC1=NC=C(S1)C(=O)O
| PubChem CID | 98845 |
|---|---|
| CAS | 40004-69-1 |
| Molecular Weight (g/mol) | 143.16 |
| MDL Number | MFCD01760300 |
| SMILES | CC1=NC=C(S1)C(=O)O |
| IUPAC Name | 2-methyl-1,3-thiazole-5-carboxylic acid |
| InChI Key | QCXCIYPOMMIBHO-UHFFFAOYSA-N |
| Molecular Formula | C5H5NO2S |
4-(4,5-Diphenyl-1H-imidazol-2-yl)benzonitrile 98.0+%, TCI America™
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CAS: 29898-72-4 Molecular Formula: C22H15N3 Molecular Weight (g/mol): 321.383 InChI Key: KGOZFYOJDPVGMV-UHFFFAOYSA-N Synonym: 2-(4-Cyanophenyl)-4,5-diphenylimidazole PubChem CID: 12099795 IUPAC Name: 4-(4,5-diphenyl-1H-imidazol-2-yl)benzonitrile SMILES: C1=CC=C(C=C1)C2=C(N=C(N2)C3=CC=C(C=C3)C#N)C4=CC=CC=C4
| PubChem CID | 12099795 |
|---|---|
| CAS | 29898-72-4 |
| Molecular Weight (g/mol) | 321.383 |
| SMILES | C1=CC=C(C=C1)C2=C(N=C(N2)C3=CC=C(C=C3)C#N)C4=CC=CC=C4 |
| Synonym | 2-(4-Cyanophenyl)-4,5-diphenylimidazole |
| IUPAC Name | 4-(4,5-diphenyl-1H-imidazol-2-yl)benzonitrile |
| InChI Key | KGOZFYOJDPVGMV-UHFFFAOYSA-N |
| Molecular Formula | C22H15N3 |
2-(1H-Pyrazol-3-yl)pyridine 98.0+%, TCI America™
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CAS: 75415-03-1 Molecular Formula: C8H7N3 Molecular Weight (g/mol): 145.17 MDL Number: MFCD00115151 InChI Key: HKEWOTUTAYJWQJ-UHFFFAOYSA-N Synonym: 2-1h-pyrazol-3-yl pyridine,2-1h-pyrazol-5-yl pyridine,2-pyrazol-3-yl-pyridine,2-1h-pyrazol-3-yl-pyridine,2-3-pyrazolyl pyridine,pyridine, 2-1h-pyrazol-3-yl,3-2-pyridyl pyrazole,2-2h-pyrazol-3-yl pyridine,2-3e-pyrazol-3-ylidene-1h-pyridine,pyrazolylpyridine PubChem CID: 2797657 IUPAC Name: 2-(1H-pyrazol-5-yl)pyridine SMILES: N1N=CC=C1C1=CC=CC=N1
| PubChem CID | 2797657 |
|---|---|
| CAS | 75415-03-1 |
| Molecular Weight (g/mol) | 145.17 |
| MDL Number | MFCD00115151 |
| SMILES | N1N=CC=C1C1=CC=CC=N1 |
| Synonym | 2-1h-pyrazol-3-yl pyridine,2-1h-pyrazol-5-yl pyridine,2-pyrazol-3-yl-pyridine,2-1h-pyrazol-3-yl-pyridine,2-3-pyrazolyl pyridine,pyridine, 2-1h-pyrazol-3-yl,3-2-pyridyl pyrazole,2-2h-pyrazol-3-yl pyridine,2-3e-pyrazol-3-ylidene-1h-pyridine,pyrazolylpyridine |
| IUPAC Name | 2-(1H-pyrazol-5-yl)pyridine |
| InChI Key | HKEWOTUTAYJWQJ-UHFFFAOYSA-N |
| Molecular Formula | C8H7N3 |
4,5-Dimethylthiazole 98.0+%, TCI America™
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CAS: 3581-91-7 Molecular Formula: C5H7NS Molecular Weight (g/mol): 113.178 MDL Number: MFCD00005336 InChI Key: UWSONZCNXUSTKW-UHFFFAOYSA-N Synonym: 4,5-dimethylthiazole,thiazole, 4,5-dimethyl,4,5-dimethyl thiazole,4,5-dimethyl-thiazole,unii-u3rp5i088g,fema no. 3274,pubchem9938,acmc-209ijb,dimethylthiazole, 4,5,4-27-00-00986 beilstein handbook reference PubChem CID: 62510 IUPAC Name: 4,5-dimethyl-1,3-thiazole SMILES: CC1=C(SC=N1)C
| PubChem CID | 62510 |
|---|---|
| CAS | 3581-91-7 |
| Molecular Weight (g/mol) | 113.178 |
| MDL Number | MFCD00005336 |
| SMILES | CC1=C(SC=N1)C |
| Synonym | 4,5-dimethylthiazole,thiazole, 4,5-dimethyl,4,5-dimethyl thiazole,4,5-dimethyl-thiazole,unii-u3rp5i088g,fema no. 3274,pubchem9938,acmc-209ijb,dimethylthiazole, 4,5,4-27-00-00986 beilstein handbook reference |
| IUPAC Name | 4,5-dimethyl-1,3-thiazole |
| InChI Key | UWSONZCNXUSTKW-UHFFFAOYSA-N |
| Molecular Formula | C5H7NS |
5-Nitroindazole 98.0+%, TCI America™
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CAS: 5401-94-5 Molecular Formula: C7H5N3O2 Molecular Weight (g/mol): 163.136 MDL Number: MFCD00005693 InChI Key: WSGURAYTCUVDQL-UHFFFAOYSA-N Synonym: 5-nitroindazole,1h-indazole, 5-nitro,unii-235y7p37zd,ccris 4134,2h-indazole, 5-nitro,5ni,5-nitroindazol,5-nitro indazole,5-nitro-indazole,5-nitro-1h-indazol PubChem CID: 21501 IUPAC Name: 5-nitro-1H-indazole SMILES: C1=CC2=C(C=C1[N+](=O)[O-])C=NN2
| PubChem CID | 21501 |
|---|---|
| CAS | 5401-94-5 |
| Molecular Weight (g/mol) | 163.136 |
| MDL Number | MFCD00005693 |
| SMILES | C1=CC2=C(C=C1[N+](=O)[O-])C=NN2 |
| Synonym | 5-nitroindazole,1h-indazole, 5-nitro,unii-235y7p37zd,ccris 4134,2h-indazole, 5-nitro,5ni,5-nitroindazol,5-nitro indazole,5-nitro-indazole,5-nitro-1h-indazol |
| IUPAC Name | 5-nitro-1H-indazole |
| InChI Key | WSGURAYTCUVDQL-UHFFFAOYSA-N |
| Molecular Formula | C7H5N3O2 |
3,3'-Methylenebis(1-tert-butyl-3-imidazolium Bromide) 98.0+%, TCI America™
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CAS: 247902-48-3 Molecular Formula: C15H26Br2N4 Molecular Weight (g/mol): 422.209 InChI Key: WKZMWHMEXVUXBS-UHFFFAOYSA-L PubChem CID: 11112632 IUPAC Name: 1-tert-butyl-3-[(3-tert-butylimidazol-1-ium-1-yl)methyl]imidazol-3-ium;dibromide SMILES: CC(C)(C)N1C=C[N+](=C1)C[N+]2=CN(C=C2)C(C)(C)C.[Br-].[Br-]
| PubChem CID | 11112632 |
|---|---|
| CAS | 247902-48-3 |
| Molecular Weight (g/mol) | 422.209 |
| SMILES | CC(C)(C)N1C=C[N+](=C1)C[N+]2=CN(C=C2)C(C)(C)C.[Br-].[Br-] |
| IUPAC Name | 1-tert-butyl-3-[(3-tert-butylimidazol-1-ium-1-yl)methyl]imidazol-3-ium;dibromide |
| InChI Key | WKZMWHMEXVUXBS-UHFFFAOYSA-L |
| Molecular Formula | C15H26Br2N4 |
1-Butyl-3-methylimidazolium Bromide 98.0+%, TCI America™
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CAS: 85100-77-2 Molecular Formula: C8H15BrN2 Molecular Weight (g/mol): 219.126 MDL Number: MFCD03427611 InChI Key: KYCQOKLOSUBEJK-UHFFFAOYSA-M Synonym: 1-butyl-3-methylimidazolium bromide,3-butyl-1-methyl-1h-imidazol-3-ium bromide,bmimbr,1-n-butyl-3-methylimidazolium bromide,1-butyl-3-methyl-1h-imidazol-3-ium bromide,bmim br,c4mim bromide,ksc491c7d,1-butyl-3-methylimidazoliumbromide PubChem CID: 2734236 IUPAC Name: 1-butyl-3-methylimidazol-3-ium;bromide SMILES: CCCCN1C=C[N+](=C1)C.[Br-]
| PubChem CID | 2734236 |
|---|---|
| CAS | 85100-77-2 |
| Molecular Weight (g/mol) | 219.126 |
| MDL Number | MFCD03427611 |
| SMILES | CCCCN1C=C[N+](=C1)C.[Br-] |
| Synonym | 1-butyl-3-methylimidazolium bromide,3-butyl-1-methyl-1h-imidazol-3-ium bromide,bmimbr,1-n-butyl-3-methylimidazolium bromide,1-butyl-3-methyl-1h-imidazol-3-ium bromide,bmim br,c4mim bromide,ksc491c7d,1-butyl-3-methylimidazoliumbromide |
| IUPAC Name | 1-butyl-3-methylimidazol-3-ium;bromide |
| InChI Key | KYCQOKLOSUBEJK-UHFFFAOYSA-M |
| Molecular Formula | C8H15BrN2 |
1-Butyl-3-methylimidazolium Trifluoro(trifluoromethyl)borate 98.0+%, TCI America™
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CAS: 741677-68-9 Molecular Formula: C9H15BF6N2 Molecular Weight (g/mol): 276.033 InChI Key: PTBVLMHYOBXNCB-UHFFFAOYSA-N PubChem CID: 44630030 IUPAC Name: 1-butyl-3-methylimidazol-3-ium;trifluoro(trifluoromethyl)boranuide SMILES: [B-](C(F)(F)F)(F)(F)F.CCCCN1C=C[N+](=C1)C
| PubChem CID | 44630030 |
|---|---|
| CAS | 741677-68-9 |
| Molecular Weight (g/mol) | 276.033 |
| SMILES | [B-](C(F)(F)F)(F)(F)F.CCCCN1C=C[N+](=C1)C |
| IUPAC Name | 1-butyl-3-methylimidazol-3-ium;trifluoro(trifluoromethyl)boranuide |
| InChI Key | PTBVLMHYOBXNCB-UHFFFAOYSA-N |
| Molecular Formula | C9H15BF6N2 |
1-(4-Cyanophenyl)imidazole 98.0+%, TCI America™
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CAS: 25372-03-6 Molecular Formula: C10H7N3 Molecular Weight (g/mol): 169.19 MDL Number: MFCD00127147 InChI Key: GYFGZFJGMRRTTP-UHFFFAOYSA-N Synonym: 4-1h-imidazol-1-yl benzonitrile,4-imidazol-1-yl benzonitrile,p-imidazol-1-ylbenzonitrile,1-4-cyanophenyl imidazole,4-1-imidazolyl benzonitrile,4-1h-imidazol-1-yl benzenecarbonitrile,benzonitrile, p-imidazol-1-yl,4-imidazolylbenzenecarbonitrile,benzonitrile, 4-1h-imidazol-1-yl,acmc-1cnga PubChem CID: 135744 IUPAC Name: 4-(1H-imidazol-1-yl)benzonitrile SMILES: N#CC1=CC=C(C=C1)N1C=CN=C1
| PubChem CID | 135744 |
|---|---|
| CAS | 25372-03-6 |
| Molecular Weight (g/mol) | 169.19 |
| MDL Number | MFCD00127147 |
| SMILES | N#CC1=CC=C(C=C1)N1C=CN=C1 |
| Synonym | 4-1h-imidazol-1-yl benzonitrile,4-imidazol-1-yl benzonitrile,p-imidazol-1-ylbenzonitrile,1-4-cyanophenyl imidazole,4-1-imidazolyl benzonitrile,4-1h-imidazol-1-yl benzenecarbonitrile,benzonitrile, p-imidazol-1-yl,4-imidazolylbenzenecarbonitrile,benzonitrile, 4-1h-imidazol-1-yl,acmc-1cnga |
| IUPAC Name | 4-(1H-imidazol-1-yl)benzonitrile |
| InChI Key | GYFGZFJGMRRTTP-UHFFFAOYSA-N |
| Molecular Formula | C10H7N3 |
4-(2-Methyl-4-thiazolyl)phenol 98.0+%, TCI America™
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CAS: 30686-73-8 Molecular Formula: C10H9NOS Molecular Weight (g/mol): 191.248 MDL Number: MFCD02642878 InChI Key: HOAYTTLLVORNLA-UHFFFAOYSA-N Synonym: 4-2-methyl-4-thiazolyl phenol,4-2-methyl-1,3-thiazol-4-yl phenol,4-2-methylthiazol-4-yl phenol,4-4-hydroxyphenyl-2-methylthiazole,4-2-methyl-4-thiazolyl phenol for biochemical research,4-2-methyl-thiazol-4-yl-phenol,phenol, p-2-methyl-4-thiazolyl,4-2-methyl-4-thiazolyl phenol*,4-2-methyl-1,3-thiazol-4-yl phenol #,phenol, 4-2-methyl-4-thiazolyl-, hydrochloride PubChem CID: 591743 IUPAC Name: 4-(2-methyl-1,3-thiazol-4-yl)phenol SMILES: CC1=NC(=CS1)C2=CC=C(C=C2)O
| PubChem CID | 591743 |
|---|---|
| CAS | 30686-73-8 |
| Molecular Weight (g/mol) | 191.248 |
| MDL Number | MFCD02642878 |
| SMILES | CC1=NC(=CS1)C2=CC=C(C=C2)O |
| Synonym | 4-2-methyl-4-thiazolyl phenol,4-2-methyl-1,3-thiazol-4-yl phenol,4-2-methylthiazol-4-yl phenol,4-4-hydroxyphenyl-2-methylthiazole,4-2-methyl-4-thiazolyl phenol for biochemical research,4-2-methyl-thiazol-4-yl-phenol,phenol, p-2-methyl-4-thiazolyl,4-2-methyl-4-thiazolyl phenol*,4-2-methyl-1,3-thiazol-4-yl phenol #,phenol, 4-2-methyl-4-thiazolyl-, hydrochloride |
| IUPAC Name | 4-(2-methyl-1,3-thiazol-4-yl)phenol |
| InChI Key | HOAYTTLLVORNLA-UHFFFAOYSA-N |
| Molecular Formula | C10H9NOS |
Potassium Bis(1-pyrazolyl)borohydride 98.0+%, TCI America™
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CAS: 18583-59-0 Molecular Formula: C6H6BKN4 Molecular Weight (g/mol): 184.05 MDL Number: MFCD00058739 InChI Key: KIXPNQZZOUCWGN-UHFFFAOYSA-N Synonym: Potassium Dihydrobis(1-pyrazolyl)borate PubChem CID: 44630456 IUPAC Name: potassium;di(pyrazol-1-yl)boranide SMILES: [B-](N1C=CC=N1)N2C=CC=N2.[K+]
| PubChem CID | 44630456 |
|---|---|
| CAS | 18583-59-0 |
| Molecular Weight (g/mol) | 184.05 |
| MDL Number | MFCD00058739 |
| SMILES | [B-](N1C=CC=N1)N2C=CC=N2.[K+] |
| Synonym | Potassium Dihydrobis(1-pyrazolyl)borate |
| IUPAC Name | potassium;di(pyrazol-1-yl)boranide |
| InChI Key | KIXPNQZZOUCWGN-UHFFFAOYSA-N |
| Molecular Formula | C6H6BKN4 |