Azoles
Methyl 1-methylimidazole-5-carboxylate, 98%, Thermo Scientific™
CAS: 17289-20-2 Molecular Formula: C6H8N2O2 Molecular Weight (g/mol): 140.14 MDL Number: MFCD01567300 InChI Key: AKDPLDCXQNEMCL-UHFFFAOYSA-N Synonym: methyl 1-methyl-1h-imidazole-5-carboxylate,methyl 1-methylimidazole-5-carboxylate,methyl1-methyl-1h-imidazole-5-carboxylate,3-methyl-3h-imidazole-4-carboxylic acid methyl ester,1h-imidazole-5-carboxylic acid, 1-methyl-, methyl ester,1-methyl-1h-imidazole-5-carboxylic acid methyl ester,pubchem9004,acmc-209e5h,1-methylimidazole-5-carboxylic acid methyl ester,1h-imidazole-5-carboxylicacid, 1-methyl-, methyl ester PubChem CID: 2736896 SMILES: COC(=O)C1=CN=CN1C
2-Bromothiazole-5-carboxylic acid, 97%
CAS: 54045-76-0 Molecular Formula: C4H2BrNO2S Molecular Weight (g/mol): 208.029 MDL Number: MFCD04115730 InChI Key: BESGTWHUMYHYEQ-UHFFFAOYSA-N Synonym: 2-bromothiazole-5-carboxylic acid,2-bromo-5-thiazolecarboxylic acid,2-bromo-5-thiazolecarboxylicacid,2-bromo-thiazole-5-carboxylic acid,2-bromo-5-carboxythiazole,5-thiazolecarboxylic acid, 2-bromo,2-bromthiazol-5-carboxylic acid,pubchem15963,acmc-1ap3n,2-bromothiazole-5-carboxylic PubChem CID: 2763210 IUPAC Name: 2-bromo-1,3-thiazole-5-carboxylic acid SMILES: C1=C(SC(=N1)Br)C(=O)O
4-(Bromomethyl)-3-methyl-5-phenylisoxazole, ≥95%, Thermo Scientific™
CAS: 113841-59-1 Molecular Formula: C11H10BrNO Molecular Weight (g/mol): 252.111 MDL Number: MFCD03086124 InChI Key: KCGVZUOBUPWFJC-UHFFFAOYSA-N PubChem CID: 2776518 IUPAC Name: 4-(bromomethyl)-3-methyl-5-phenyl-1,2-oxazole SMILES: CC1=NOC(=C1CBr)C2=CC=CC=C2
1-methyl-1h-pyrazole-4-carbonyl chloride, 97%, Thermo Scientific™
CAS: 79583-19-0 Molecular Formula: C5H5ClN2O Molecular Weight (g/mol): 144.558 MDL Number: MFCD03421496 InChI Key: QLBBQLJPRXPVOS-UHFFFAOYSA-N Synonym: 1-methyl-1h-pyrazole-4-carbonyl chloride,1h-pyrazole-4-carbonyl chloride, 1-methyl,1h-pyrazole-4-carbonylchloride, 1-methyl,1-methyl-1h-pyrazole-4-carboxylic acid chloride,1h-pyrazole-4-carbonyl chloride, 1-methyl-9ci PubChem CID: 3164931 IUPAC Name: 1-methylpyrazole-4-carbonyl chloride SMILES: CN1C=C(C=N1)C(=O)Cl
2,5-Dimethyl-1,3-oxazole-4-carboxylic acid, 97%, Thermo Scientific™
CAS: 23000-14-8 Molecular Formula: C6H7NO3 Molecular Weight (g/mol): 141.126 MDL Number: MFCD03011595 InChI Key: LHGRUGVXZLHYKE-UHFFFAOYSA-N Synonym: 2,5-dimethyloxazole-4-carboxylic acid,dimethyl-1,3-oxazole-4-carboxylic acid,4-oxazolecarboxylic acid, 2,5-dimethyl,2,5-dimethyl-1,3-oxazole-4-carboxylicacid,4-carboxy-2,5-dimethyl-1,3-oxazole,2,5-dimethyl-oxazole-4-carboxylic acid,2.5-dimethyl-1,3-oxazole-4-carboxylic acid PubChem CID: 2795465 IUPAC Name: 2,5-dimethyl-1,3-oxazole-4-carboxylic acid SMILES: CC1=C(N=C(O1)C)C(=O)O
1-n-Butyl-3-methylimidazolium dicyanamide, 97%
CAS: 448245-52-1 Molecular Formula: C10H15N5 Molecular Weight (g/mol): 205.265 MDL Number: MFCD07784457 InChI Key: ICIVTHOGIQHZRY-UHFFFAOYSA-N Synonym: 1-butyl-3-methylimidazolium dicyanamide,1-butyl-3-methylimidazolium dicyamide,1-butyl-3-methylimidazolium; dicyanoazanide,bmim dca,dsstox_cid_27886,dsstox_rid_82639,dsstox_gsid_47910,c4mim; dicyanoazanide,1-butyl-3-methyl-1h-imidazol-3-ium cyanoimino methylidene azanide,1-butyl-3-methylimidazolium; cyanoimino methylidene azanide PubChem CID: 11171745 IUPAC Name: 1-butyl-3-methylimidazol-3-ium;cyanoiminomethylideneazanide SMILES: CCCCN1C=C[N+](=C1)C.C(=[N-])=NC#N
(5-Phenyl-1,3-oxazol-4-yl)methanol, ≥95%, Thermo Scientific™
CAS: 352018-88-3 Molecular Formula: C10H9NO2 Molecular Weight (g/mol): 175.187 MDL Number: MFCD03086105 InChI Key: LVHWTAMRDRDXJP-UHFFFAOYSA-N Synonym: 5-phenyloxazol-4-yl methanol,5-phenyl-1,3-oxazol-4-yl methanol,5-phenyl-1,3-oxazole-4-methanol,4-oxazolemethanol,5-phenyl,5-phenyl-4-oxazolyl methanol,5-phenyl-oxazol-4-yl-methanol,5-phenyl-1,3-oxazol-4-yl methan-1-ol PubChem CID: 2776302 IUPAC Name: (5-phenyl-1,3-oxazol-4-yl)methanol SMILES: C1=CC=C(C=C1)C2=C(N=CO2)CO
1-Methyl-2-(tri-n-butylstannyl)imidazole, 90+%, Thermo Scientific Chemicals
CAS: 105494-69-7 Molecular Formula: C16H32N2Sn Molecular Weight (g/mol): 371.156 MDL Number: MFCD01319030 InChI Key: KFWFYOPKNSYTMV-UHFFFAOYSA-N Synonym: 1-methyl-2-tributylstannyl-1h-imidazole,1-methyl-2-tributylstannyl imidazole,1-methyl-2-tri-n-butylstannyl imidazole,1-methyl-1h-imidazol-2-yl tributylstannane,1-methyl-2-tributylstannanyl-1h-imidazole,acmc-20aotl,tributyl-1-methylimidazol-2-yl stannane,n-methyl 2-tributylstannylimidazole,2-tri-n-butylstannyl-n-methylimidazole PubChem CID: 2763252 IUPAC Name: tributyl-(1-methylimidazol-2-yl)stannane SMILES: CCCC[Sn](CCCC)(CCCC)C1=NC=CN1C
1-methyl-1h-indazole-3-carbonyl chloride, 97%, Thermo Scientific™
CAS: 106649-02-9 Molecular Formula: C9H7ClN2O Molecular Weight (g/mol): 194.62 MDL Number: MFCD02093096 InChI Key: NPNWVMBPSINFBV-UHFFFAOYSA-N Synonym: 1-methyl-1h-indazole-3-carbonyl chloride,1h-indazole-3-carbonylchloride, 1-methyl,1-methyl-1h-indazol-3-carbonyl chloride,1h-indazole-3-carbonyl chloride, 1-methyl,acmc-20mac8,1-methyl-3-indazolylcarbonyl chloride,1-methyl-indazole-3-carbonyl chloride,1-methyl-1h-indazole-3-carboxychloride,1-methyl-1h-indazole-3-carboxylic acid chloride PubChem CID: 7022055 IUPAC Name: 1-methylindazole-3-carbonyl chloride SMILES: CN1N=C(C(Cl)=O)C2=CC=CC=C12
4-Methyl-5-imidazolecarboxaldehyde, 99%
CAS: 68282-53-1 Molecular Formula: C5H6N2O Molecular Weight (g/mol): 110.12 MDL Number: MFCD00173728 InChI Key: KMWCSNCNHSEXIF-UHFFFAOYSA-N Synonym: 4-methyl-1h-imidazole-5-carbaldehyde,5-methylimidazole-4-carboxaldehyde,4-methylimidazole-5-carboxaldehyde,4-methyl-5-imidazolecarboxaldehyde,5-methyl-3h-imidazole-4-carbaldehyde,4-methylimidazole-5-carbaldehyde,1h-imidazole-4-carboxaldehyde, 5-methyl,1h-imidazole-5-carboxaldehyde, 4-methyl,pubchem23016,acmc-1b6zs PubChem CID: 2795887 IUPAC Name: 5-methyl-1H-imidazole-4-carbaldehyde SMILES: CC1=C(C=O)N=CN1
5-Bromo-1H-indazole, 97%
CAS: 53857-57-1 Molecular Formula: C7H5BrN2 Molecular Weight (g/mol): 197.04 MDL Number: MFCD00839493,MFCD26227374 InChI Key: STVHMYNPQCLUNJ-UHFFFAOYSA-N Synonym: 5-bromoindazole,5-bromo-2h-indazole,1h-indazole, 5-bromo,5-bromo-1hindazole,chembl16425,5-brom-1h-indazol,5-bromoazaindole,5-bromo indazole,5-bromo-indazole PubChem CID: 761929 IUPAC Name: 5-bromo-1H-indazole SMILES: BrC1=CC=C2NN=CC2=C1
3-Methyl-4-nitro-1H-pyrazole, 97%
CAS: 5334-39-4 Molecular Formula: C4H5N3O2 Molecular Weight (g/mol): 127.10 MDL Number: MFCD00037864 InChI Key: WTZYTQJELOHMMJ-UHFFFAOYSA-N Synonym: 3-methyl-4-nitro-1h-pyrazole,3-methyl-4-nitropyrazole,1h-pyrazole, 3-methyl-4-nitro,3-methyl-4-nitro pyrazole,3-me-4-no2 pyrazole,5-methyl-4-nitropyrazole,acmc-209l6a,ksc497o4j,4-nitro-5-methyl-1h-pyrazole,3-methyl-4-nitro-1h-pyrazole # PubChem CID: 79255 IUPAC Name: 5-methyl-4-nitro-1H-pyrazole SMILES: CC1=C(C=NN1)[N+]([O-])=O
ethyle2-mercapto-1H-imidazole-4-carboxylate, 97%, Thermo Scientific™
CAS: 64038-64-8 Molecular Formula: C6H8N2O2S Molecular Weight (g/mol): 172.202 MDL Number: MFCD00068042 InChI Key: PONOGPICUOALRU-UHFFFAOYSA-N Synonym: ethyl 2-mercapto-1h-imidazole-4-carboxylate,4-ethoxycarbonylimidazole-2-thiol,usaf el-63,imidazole-2-thiol, 5-ethoxycarbonyl,2-mercapto-5-carbethoxyimidazole,imidazole, 2-mercapto-5-carbethoxy,ethyl 2-sulfanyl-1h-imidazole-4-carboxylate,2-mercapto-1h-imidazole-4-carboxylic acid ethyl ester,ethyl 2-mercaptoimidazole-4-carboxylate,maybridge1_005066 PubChem CID: 2736338 IUPAC Name: ethyl 2-sulfanylidene-1,3-dihydroimidazole-4-carboxylate SMILES: CCOC(=O)C1=CNC(=S)N1
Ornidazole, 99%
CAS: 16773-42-5 Molecular Formula: C7H10ClN3O3 Molecular Weight (g/mol): 219.625 MDL Number: MFCD00057960 InChI Key: IPWKIXLWTCNBKN-UHFFFAOYSA-N Synonym: ornidazole,madelen,tiberal,ornidazolum,1-3-chloro-2-hydroxypropyl-2-methyl-5-nitroimidazole,ornidazol,1-chloro-3-2-methyl-5-nitro-1h-imidazol-1-yl propan-2-ol,1-chloro-3-2-methyl-5-nitro-1h-imidazol-1-yl-2-propanol,ornidal,1-2-hydroxy-3-chloropropyl-2-methyl-5-nitroimidazole PubChem CID: 28061 ChEBI: CHEBI:75176 IUPAC Name: 1-chloro-3-(2-methyl-5-nitroimidazol-1-yl)propan-2-ol SMILES: CC1=NC=C(N1CC(CCl)O)[N+](=O)[O-]