Organoheterocyclic compounds
epsilon-Caprolactone, 99%
CAS: 502-44-3 Molecular Formula: C6H10O2 Molecular Weight (g/mol): 114.144 MDL Number: MFCD00003267 InChI Key: PAPBSGBWRJIAAV-UHFFFAOYSA-N Synonym: 6-hexanolactone,epsilon-caprolactone,2-oxepanone,caprolactone,hexan-6-olide,6-hexanolide,hexano-6-lactone,1,6-hexanolide,e-caprolactone,1-oxa-2-oxocycloheptane PubChem CID: 10401 ChEBI: CHEBI:17915 IUPAC Name: oxepan-2-one SMILES: C1CCC(=O)OCC1
cis-Bis(2,2'-bipyridine)dichlororuthenium(II) hydrate, 97%
CAS: 98014-14-3 Molecular Formula: C20H16Cl2N4Ru Molecular Weight (g/mol): 484.35 MDL Number: MFCD00150005 InChI Key: MGAJEYXQYJBLQL-UHFFFAOYSA-L Synonym: cis-bis 2,2'-bipyridine dichlororuthenium ii hydrate,bis bipyridyl dichlororuthenium hydrate,2,2'-bipyridine-dichlororuthenium-water 2/1/1,cis-dichlorobis 2,2'-bipyridine ruthenium ii,cis-bis 2,2'-bipyridine dichlororuthenium ii monohydrate,cis-bis 2,2-bipyridine dichlororuthenium ii hydrate,cis-bis-2,2'-bipyridine ruthenium ii chloride,hydrate,cis-bis 2,2 inverted exclamation marka-bipyridine dichlororuthenium ii hydrate PubChem CID: 16211844 SMILES: Cl[Ru]Cl.C1=CN=C(C=C1)C1=NC=CC=C1.C1=CN=C(C=C1)C1=NC=CC=C1
Norharman, 98%
CAS: 244-63-3 Molecular Formula: C11H8N2 Molecular Weight (g/mol): 168.20 MDL Number: MFCD00004956 InChI Key: AIFRHYZBTHREPW-UHFFFAOYSA-N Synonym: 9h-pyrido 3,4-b indole,norharman,norharmane,beta-carboline,carbazoline,2,9-diazafluorene,9h-beta-carboline,2-azacarbazole,.beta.-carboline PubChem CID: 64961 ChEBI: CHEBI:109895 IUPAC Name: 9H-pyrido[3,4-b]indole SMILES: N1C2=C(C=CC=C2)C2=C1C=NC=C2
Azure I
CAS: 531-55-5 Molecular Formula: C15H16ClN3S Molecular Weight (g/mol): 305.824 MDL Number: MFCD00011935 InChI Key: DNDJEIWCTMMZBX-UHFFFAOYSA-N Synonym: azure b,azure i,methylene azure b,3-dimethylamino-7-methylamino phenothiazin-5-ium chloride,trimethylthionine chloride,azur i,methyleneazure,methylene azure van,unii-7c8bel8wqv,modr kresylova bb czech PubChem CID: 68275 IUPAC Name: dimethyl-[7-(methylamino)phenothiazin-3-ylidene]azanium;chloride SMILES: CNC1=CC2=C(C=C1)N=C3C=CC(=[N+](C)C)C=C3S2.[Cl-]
(+)-Quinidine
CAS: 56-54-2 Molecular Formula: C20H24N2O2 Molecular Weight (g/mol): 324.42 MDL Number: MFCD00135581,MFCD00198096 InChI Key: LOUPRKONTZGTKE-LHHVKLHASA-N Synonym: quinidine,+-quinidine,chinidin,pitayine,cin-quin,8r,9s-quinidine,conquinine,conchinin,quinidex,conchinine PubChem CID: 441074 ChEBI: CHEBI:28593 IUPAC Name: (S)-[(2R,4S,5R)-5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl]-(6-methoxyquinolin-4-yl)methanol SMILES: COC1=CC=C2N=CC=C([C@H](O)[C@H]3C[C@@H]4CCN3C[C@@H]4C=C)C2=C1
1-Methyl-4-piperidone, 98%
CAS: 1445-73-4 Molecular Formula: C6H11NO Molecular Weight (g/mol): 113.16 MDL Number: MFCD00006191 InChI Key: HUUPVABNAQUEJW-UHFFFAOYSA-N Synonym: 1-methyl-4-piperidone,n-methyl-4-piperidone,1-methyl-4-piperidinone,4-piperidinone, 1-methyl,4-piperidone, 1-methyl,n-methyl-4-piperidinone,1-methyl-4-piperidione,n-methylpiperidine-4-one,1-methyl-4-oxopiperidine,1-methylpiperidine-4-one PubChem CID: 74049 IUPAC Name: 1-methylpiperidin-4-one SMILES: CN1CCC(=O)CC1
Ethyl 2-methyl-4-phenyl-1,3-thiazole-5-carboxylate, 97%, Thermo Scientific™
CAS: 32043-95-1 Molecular Formula: C13H13NO2S Molecular Weight (g/mol): 247.31 MDL Number: MFCD07346320 InChI Key: UHLMXNFHHFDVPW-UHFFFAOYSA-N Synonym: ethyl 2-methyl-4-phenylthiazole-5-carboxylate,2-methyl-4-phenylthiazole-5-carboxylic acid ethyl ester,2-methyl-4-phenyl-thiazole-5-carboxylic acid ethyl ester,5-thiazolecarboxylicacid, 2-methyl-4-phenyl-, ethyl ester PubChem CID: 7131013 IUPAC Name: ethyl 2-methyl-4-phenyl-1,3-thiazole-5-carboxylate SMILES: CCOC(=O)C1=C(N=C(C)S1)C1=CC=CC=C1
Coproporphyrin I Tetramethyl Ester, Sigma-Aldrich
Molecular Weight (g/mol): 710.82 g/mol
Quinoline, 98%
CAS: 91-22-5 Molecular Formula: C9H7N Molecular Weight (g/mol): 129.16 MDL Number: MFCD00006736,MFCD06637409,MFCD31699982,MFCD31699983,MFCD31699984,MFCD31699985,MFCD31699986,MFCD31699987 InChI Key: SMWDFEZZVXVKRB-UHFFFAOYSA-N Synonym: chinolin,chinoline,1-benzazine,quinolin,1-azanaphthalene,chinoleine,leucol,benzo b pyridine,benzopyridine,leukol PubChem CID: 7047 ChEBI: CHEBI:17362 IUPAC Name: quinoline SMILES: C1=CC=C2N=CC=CC2=C1
Chloroxazone, 98%
CAS: 95-25-0 Molecular Formula: C7H4ClNO2 Molecular Weight (g/mol): 169.57 MDL Number: MFCD00005717 InChI Key: TZFWDZFKRBELIQ-UHFFFAOYSA-N Synonym: chlorzoxazone,chlorzoxazon,paraflex,chloroxazone,5-chloro-2-benzoxazolone,biomioran,escoflex,myoflexin,myoflexine,pathorysin PubChem CID: 2733 ChEBI: CHEBI:3655 IUPAC Name: 5-chloro-3H-1,3-benzoxazol-2-one SMILES: C1=CC2=C(C=C1Cl)NC(=O)O2
Ethyl tetrahydropyran-4-ylacetate, 97%, Thermo Scientific™
CAS: 103260-44-2 Molecular Formula: C9H16O3 Molecular Weight (g/mol): 172.224 InChI Key: JLMMMEDWRUVCEW-UHFFFAOYSA-N Synonym: ethyl tetrahydropyran-4-ylacetate,ethyl 2-tetrahydro-2h-pyran-4-yl acetate,ethyl 2-oxan-4-yl acetate,ethyl tetrahydropyran-4-yl-acetate,ethyl 2-4-tetrahydropyranyl acetate,ethyl tetrahydropyranyl-4-acetate,2h-pyran-4-acetic acid, tetrahydro-, ethyl ester,ethyl tetrahydropyran-4-acetate,tetrahydro-pyran-4-yl-acetic acid ethyl ester,ethyl tetrahydro-2h-pyran-4-ylacetate PubChem CID: 2773412 IUPAC Name: ethyl 2-(oxan-4-yl)acetate SMILES: CCOC(=O)CC1CCOCC1
4-(2-Trifluoromethyl-benzoimidazol-1-yl)-butyric acid, ≥97%, Thermo Scientific™
CAS: 876728-42-6 Molecular Formula: C12H11F3N2O2 Molecular Weight (g/mol): 272.227 MDL Number: MFCD07397470 InChI Key: HQUSGKZLJZMIHU-UHFFFAOYSA-N Synonym: 4-2-trifluoromethyl-1h-benzimidazol-1-yl butanoic acid,4-2-trifluoromethyl-benzoimidazol-1-yl-butyric acid,4-2-trifluoromethyl benzimidazolyl butanoic acid,1h-benzimidazole-1-butanoicacid, 2-trifluoromethyl,4-2-trifluoromethyl benzimidazol-1-yl butanoic acid,4-2-trifluoromethyl-1,3-benzodiazol-1-yl butanoic acid,4-2-trifluoromethyl-1h-benzimidazol-1-yl-butanoic acid,4-2-trifluoromethyl-1-benzimidazolyl butanoic acid,4-2-trifluoromethyl-1h-benzo d imidazol-1-yl butanoic acid PubChem CID: 6494232 IUPAC Name: 4-[2-(trifluoromethyl)benzimidazol-1-yl]butanoic acid SMILES: C1=CC=C2C(=C1)N=C(N2CCCC(=O)O)C(F)(F)F
2-chloro-6-methoxyisonicotinic acid, 97%, Thermo Scientific™
CAS: 15855-06-8 Molecular Formula: C7H6ClNO3 Molecular Weight (g/mol): 187.579 MDL Number: MFCD00173928 InChI Key: PJQBTHQTVJMCFX-UHFFFAOYSA-N Synonym: 2-chloro-6-methoxyisonicotinic acid,2-chloro-6-methoxy-isonicotinic acid,4-pyridinecarboxylic acid, 2-chloro-6-methoxy,2-chloro-6-methoxy-4-pyridinecarboxylic acid,2-chloro-6-methoxyisonicotinicacid,acmc-1bs54,ksc173i0h,2-chloro-6-methoxypyridine-4-carboxylicacid PubChem CID: 2782124 IUPAC Name: 2-chloro-6-methoxypyridine-4-carboxylic acid SMILES: COC1=NC(=CC(=C1)C(=O)O)Cl
Furan-3-boronic acid, 97%
CAS: 55552-70-0 Molecular Formula: C4H5BO3 Molecular Weight (g/mol): 111.89 MDL Number: MFCD01319007 InChI Key: CYEFKCRAAGLNHW-UHFFFAOYSA-N Synonym: furan-3-boronic acid,3-furanboronic acid,3-furylboronic acid,furan-3-yl boronic acid,3-furanylboronic acid,furan-3-ylboranediol,3-furan boronic acid,furan-3-yl-3-boronic acid,furan-3-yl-boronic acid,boronic acid, 3-furanyl PubChem CID: 2734358 IUPAC Name: furan-3-ylboronic acid SMILES: OB(O)C1=COC=C1
6-Oxo-1,6-dihydropyridazine-3-carboxylic acid monohydrate, 97%, Thermo Scientific™
CAS: 37972-69-3 Molecular Formula: C5H3N2O3 Molecular Weight (g/mol): 139.09 MDL Number: MFCD09064936 InChI Key: GIFSROMQVPUQFK-UHFFFAOYSA-M Synonym: 6-hydroxypyridazine-3-carboxylic acid,6-hydroxy-3-pyridazinecarboxylic acid,6-oxo-1,6-dihydropyridazine-3-carboxylic acid,6-oxo-1,6-dihydro-pyridazine-3-carboxylic acid,3-hydroxypyridazine-6-carboxylic acid,3-pyridazinecarboxylic acid, 1,6-dihydro-6-oxo,6-hydroxy-pyridazine-3-carboxylic acid,6-oxo-1,6-dihydro-3-pyridazinecarboxylic acid,3-pyridazinecarboxylicacid, 1,6-dihydro-6-oxo,6-oxohydropyridazine-3-carboxylic acid PubChem CID: 305970 IUPAC Name: 6-oxo-1H-pyridazine-3-carboxylic acid SMILES: [O-]C(=O)C1=NNC(=O)C=C1