Organoheterocyclic compounds
7-Methylxanthine, 98%
CAS: 552-62-5 Molecular Formula: C6H6N4O2 Molecular Weight (g/mol): 166.14 MDL Number: MFCD00037979 InChI Key: PFWLFWPASULGAN-UHFFFAOYSA-N Synonym: 7-methylxanthine,heteroxanthine,heteroxanthin,7-methylxanthin,7-methyl-1h-purine-2,6 3h,7h-dione,2,6-dihydroxy-7-methylpurine,xanthine, 7-methyl,3,7-dihydro-7-methyl-1h-purine-2,6-dione,7-methyl-3,7-dihydro-1h-purine-2,6-dione,1h-purine-2,6-dione, 3,7-dihydro-7-methyl PubChem CID: 68374 ChEBI: CHEBI:48991 SMILES: CN1C=NC2=C1C(=O)NC(=O)N2
3-Methylxanthine, 99.43%, For HPLC analysis, MP Biomedicals™
CAS: 1076-22-8 Molecular Formula: C6H6N4O2 Molecular Weight (g/mol): 166.14 InChI Key: GMSNIKWWOQHZGF-UHFFFAOYSA-N Synonym: 3-methylxanthine,3-methyl-1h-purine-2,6 3h,7h-dione,2,6-dihydroxy-3-methylpurine,xanthine, 3-methyl,3 mx,3-methyl xanthine,1h-purine-2,6-dione, 3,7-dihydro-3-methyl,unii-ws6x982oec,3-methyl-2,3,6,7-tetrahydro-1h-purine-2,6-dione,ccris 5817 PubChem CID: 70639 ChEBI: CHEBI:62207 IUPAC Name: 3-methyl-7H-purine-2,6-dione SMILES: CN1C2=C(C(=O)NC1=O)NC=N2
Caffeine monohydrate, MP Biomedicals™
CAS: 58-08-2 Molecular Formula: C8H10N4O2 Molecular Weight (g/mol): 194.19 MDL Number: MFCD00005758 InChI Key: RYYVLZVUVIJVGH-UHFFFAOYSA-N Synonym: caffeine,1,3,7-trimethylxanthine,guaranine,thein,cafeina,methyltheobromine,koffein,mateina,theine,alert-pep PubChem CID: 2519 ChEBI: CHEBI:27732 IUPAC Name: 1,3,7-trimethyl-2,3,6,7-tetrahydro-1H-purine-2,6-dione SMILES: CN1C=NC2=C1C(=O)N(C)C(=O)N2C
Mirtazapine, 98%
CAS: 85650-52-8 Molecular Formula: C17H19N3 Molecular Weight (g/mol): 265.35 InChI Key: RONZAEMNMFQXRA-UHFFFAOYSA-N Synonym: mirtazapine,remeron,mepirzepine,remergil,zispin,remergon,rexer,6-azamianserin,remeron soltab,mepirzapin PubChem CID: 4205 ChEBI: CHEBI:6950 SMILES: CN1CCN2C(C1)C3=CC=CC=C3CC4=C2N=CC=C4
(S)-(+)-5-Hydroxymethyl-2-pyrrolidinone, 97%
CAS: 17342-08-4 Molecular Formula: C5H9NO2 Molecular Weight (g/mol): 115.13 MDL Number: MFCD00077792 InChI Key: HOBJEFOCIRXQKH-BYPYZUCNSA-N Synonym: l-pyroglutaminol,s-+-5-hydroxymethyl-2-pyrrolidinone,5s-5-hydroxymethyl pyrrolidin-2-one,s-5-hydroxymethyl pyrrolidin-2-one,s-5-hydroxymethyl-2-pyrrolidinone,2-pyrrolidinone, 5-hydroxymethyl-, 5s,s-pyroglutaminol,l-pyroglutamol,pubchem13847 PubChem CID: 643511 IUPAC Name: (5S)-5-(hydroxymethyl)pyrrolidin-2-one SMILES: C1CC(=O)NC1CO
N-(3-Aminopropyl)pyrrolidine, 98%
CAS: 23159-07-1 Molecular Formula: C7H16N2 Molecular Weight (g/mol): 128.22 MDL Number: MFCD00014100 InChI Key: VPBWZBGZWHDNKL-UHFFFAOYSA-N Synonym: 3-pyrrolidin-1-yl propan-1-amine,1-3-aminopropyl pyrrolidine,1-3-aminopropyl-pyrrolidine,1-pyrrolidinepropanamine,n-3-aminopropyl pyrrolidine,3-pyrrolidinopropylamine,3-1-pyrrolidinyl propylamine,pyrrolidine, 1-3-aminopropyl,3-pyrrolidin-1-ylpropylamine,3-1-pyrrolidino propylamine PubChem CID: 31670 IUPAC Name: 3-pyrrolidin-1-ylpropan-1-amine SMILES: C1CCN(C1)CCCN
(S)-(-)-4-Hydroxy-2-pyrrolidinone, 98%, Thermo Scientific Chemicals
CAS: 68108-18-9 Molecular Formula: C4H7NO2 Molecular Weight (g/mol): 101.1 InChI Key: IOGISYQVOGVIEU-VKHMYHEASA-N Synonym: s-4-hydroxy-2-pyrrolidinone,s-4-hydroxypyrrolidin-2-one,s-4-hydroxy-2-pyrrolidone,s-4-hydroxypyrrolidine-2-one,4s-4-hydroxypyrrolidin-2-one,s---4-hydroxy-2-pyrrolidinone,2-pyrrolidinone, 4-hydroxy-, 4s,s---4-hydroxy-2-pyrrolidone,s-4-hydroxy-pyrrolidine-2-one,4s-4-hydroxy-2-pyrrolidinone PubChem CID: 155084 IUPAC Name: (4S)-4-hydroxypyrrolidin-2-one SMILES: C1C(CNC1=O)O
4,4-Dimethyl-2-pyrrolidinone, 95%
CAS: 66899-02-3 Molecular Formula: C6H11NO Molecular Weight (g/mol): 113.16 MDL Number: MFCD09864496 InChI Key: HGVPKAGCVCGRDQ-UHFFFAOYSA-N PubChem CID: 637593 IUPAC Name: 4,4-dimethylpyrrolidin-2-one SMILES: CC1(CC(=O)NC1)C
Castanospermine, 99%
CAS: 79831-76-8 Molecular Formula: C8H15NO4 Molecular Weight (g/mol): 189.211 MDL Number: MFCD00017555 InChI Key: JDVVGAQPNNXQDW-TVNFTVLESA-N Synonym: castanospermine,castinospermine,1,6,7,8-tetrahydroxyoctahydroindolizine,1s,6s,7r,8r,8ar-1,6,7,8-tetrahydroxyindolizidine,6-epicastanospermine,unii-q0i3184xm7,6,7-diepicastanospermine,castanospermine, castanospermum australe,1s,6s,7r,8ar-tetrahydroxyoctahydroindolizine,1s,6s,7r,8r,8ar-octahydroindolizine-1,6,7,8-tetrol PubChem CID: 54445 ChEBI: CHEBI:27860 IUPAC Name: (1S,6S,7R,8R,8aR)-1,2,3,5,6,7,8,8a-octahydroindolizine-1,6,7,8-tetrol SMILES: C1CN2CC(C(C(C2C1O)O)O)O
7-Chloro-1,2,3,4-tetrahydroisoquinoline hydrochloride, 98%
CAS: 73075-45-3 Molecular Formula: C9H11Cl2N Molecular Weight (g/mol): 204.094 MDL Number: MFCD08461076 InChI Key: OGIAIXMUSSACDB-UHFFFAOYSA-N Synonym: 7-chloro-1,2,3,4-tetrahydroisoquinoline hydrochloride,7-chloro-1,2,3,4-tetrahydroisoquinolinehydrochloride,isoquinoline, 7-chloro-1,2,3,4-tetrahydro-, hydrochloride,7-chloro-1,2,3,4-tetrahydro-isoquinoline hcl,7-chhloro-1,2,3,4-tetrahydroisoquinoline hydrochloride,7-chloro-1,2,3,4-tetrahydroisoquinoline hydrochlor,7-chloro-1,2,3,4-tetrahydroisoquinoline-hydrogen chloride 1/1 PubChem CID: 12595070 IUPAC Name: 7-chloro-1,2,3,4-tetrahydroisoquinoline;hydrochloride SMILES: C1CNCC2=C1C=CC(=C2)Cl.Cl
2-Chloro-1-methylbenzimidazole, Thermo Scientific Chemicals
CAS: 1849-02-1 Molecular Formula: C8H7ClN2 Molecular Weight (g/mol): 166.61 MDL Number: MFCD00769821 InChI Key: UXZYKSFMGDWHGJ-UHFFFAOYSA-N Synonym: 2-chloro-1-methyl-1h-benzo d imidazole,2-chloro-1-methyl-1h-benzimidazole,2-chloro-1-methyl-1h-benzoimidazole,2-chloro-1-methyl-1,3-benzodiazole,1-methyl-1h-benzo d imidazol-2-yl chloride,2-chloro-1-methyl-1h-1,3-benzodiazole,1-methyl-2-chlorobenzimidazole,2-chloro-1-methyl-benzimidazole,1h-benzimidazole, 2-chloro-1-methyl,acmc-209em7 PubChem CID: 663080 IUPAC Name: 2-chloro-1-methylbenzimidazole SMILES: CN1C(Cl)=NC2=CC=CC=C12
2-(2-Methyl-1H-imidazol-1-yl)aniline, 97%, Thermo Scientific™
CAS: 26286-55-5 Molecular Formula: C10H11N3 Molecular Weight (g/mol): 173.22 MDL Number: MFCD08699292 InChI Key: LLSZMUSXQITSSJ-UHFFFAOYSA-N Synonym: 2-2-methyl-1h-imidazol-1-yl aniline,2-2-methyl-imidazol-1-yl-phenylamine,benzenamine,2-2-methyl-1h-imidazol-1-yl,2-2-methylimidazol-1-yl aniline,2-2-methylimidazolyl phenylamine,1-2-amino phenyl-2-methylimidazole,2-2-methylimidazol-1-yl phenylamine PubChem CID: 13656108 IUPAC Name: 2-(2-methylimidazol-1-yl)aniline SMILES: CC1=NC=CN1C1=CC=CC=C1N
Methyle1-methyl-1H-imidazole-5-carboxylate, 97%, 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 IUPAC Name: methyl 3-methylimidazole-4-carboxylate SMILES: COC(=O)C1=CN=CN1C
2-Phenylimidazole, 98%
CAS: 670-96-2 Molecular Formula: C9H8N2 Molecular Weight (g/mol): 144.18 MDL Number: MFCD00005186 InChI Key: ZCUJYXPAKHMBAZ-UHFFFAOYSA-N Synonym: 2-phenylimidazole,1h-imidazole, 2-phenyl,imidazole, 2-phenyl,2-phenyl imidazole,2-phenyl-1h-imidazol,unii-7r2590hm4l,chembl14189,phenyl imidazole,2-phenyl-imidazole,piy PubChem CID: 69591 IUPAC Name: 2-phenyl-1H-imidazole SMILES: N1C=CN=C1C1=CC=CC=C1
1,2-Dimethyl-5-nitroimidazole, 98%
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-nitroimidazole SMILES: CN1C(C)=NC=C1[N+]([O-])=O