Organoheterocyclic compounds
1-(n-Butyl)imidazole, 99%
CAS: 4316-42-1 Molecular Formula: C7H12N2 Molecular Weight (g/mol): 124.19 MDL Number: MFCD00042753 InChI Key: MCMFEZDRQOJKMN-UHFFFAOYSA-N Synonym: 1-butyl-1h-imidazole,1h-imidazole, 1-butyl,n-butylimidazole,1-n-butylimidazole,n-n-butyl imidazole,1-n-butyl imidazole,1-buthylimidazole,n-n-butylimidazole,imidazole, 1-butyl PubChem CID: 61347 IUPAC Name: 1-butyl-1H-imidazole SMILES: CCCCN1C=CN=C1
Tetrathiafulvalene, 97%
CAS: 31366-25-3 Molecular Formula: C6H4S4 Molecular Weight (g/mol): 204.338 MDL Number: MFCD00005492 InChI Key: FHCPAXDKURNIOZ-UHFFFAOYSA-N Synonym: tetrathiafulvalene,2-1,3-dithiol-2-ylidene-1,3-dithiole,1,3-dithiole, 2-1,3-dithiol-2-ylidene,unii-hy1en16w9t,1,4,5,8-tetrathiafulvalene,ttf,delta-2:2'-bis 1,3-dithiazole,hy1en16w9t,2,2'-bi-1,3-dithiole,delta-2,2'-bi-1,3-dithiole PubChem CID: 99451 ChEBI: CHEBI:52444 IUPAC Name: 2-(1,3-dithiol-2-ylidene)-1,3-dithiole SMILES: C1=CSC(=C2SC=CS2)S1
5-(2-Methylphenyl)-1H-tetrazole, 99%
CAS: 51449-86-6 Molecular Formula: C8H8N4 Molecular Weight (g/mol): 160.18 MDL Number: MFCD03093095 InChI Key: MTBUOESFHRORQT-UHFFFAOYSA-N Synonym: 5-2-methylphenyl-1h-tetrazole,5-o-tolyl-1h-tetrazole,5-o-tolyl-2h-tetrazole,5-2-methylphenyl-2h-tetrazole,5-2-methylphenyl tetrazole,5-2-methylphenyl-2h-1,2,3,4-tetrazole,2h-tetrazole,5-2-methylphenyl,5-2-methylphenyl-1h-1,2,3,4-tetrazole,2-methylphenyltetrazole,5-o-tolyl tetrazole PubChem CID: 583067 IUPAC Name: 5-(2-methylphenyl)-2H-tetrazole SMILES: CC1=CC=CC=C1C2=NNN=N2
4-Amino-6-chloro-2-methylmercaptopyrimidine, 97%
CAS: 1005-38-5 Molecular Formula: C5H6ClN3S Molecular Weight (g/mol): 175.64 MDL Number: MFCD00006088 InChI Key: ISUXMAHVLFRZQU-UHFFFAOYSA-N Synonym: 4-amino-6-chloro-2-methylthio pyrimidine,4-amino-6-chloro-2-methylmercaptopyrimidine,4-pyrimidinamine, 6-chloro-2-methylthio,6-chloro-2-methylsulfanyl pyrimidin-4-amine,6-chloro-2-methylthio pyrimidin-4-amine,pyrimidine, 4-amino-6-chloro-2-methylthio,4-amino-6-chloro-2-methylthiopyrimidine,6-chloro-2-methylthiopyrimidin-4-ylamine,6-amino-4-chloro-2-methylmercaptopyrimidine,6-chloro-2-methylsulfanyl-pyrimidin-4-amine PubChem CID: 70496 IUPAC Name: 6-chloro-2-methylsulfanylpyrimidin-4-amine SMILES: CSC1=NC(=CC(=N1)Cl)N
Acemetacin
CAS: 53164-05-9 Molecular Formula: C21H18ClNO6 Molecular Weight (g/mol): 415.826 MDL Number: MFCD00151473 InChI Key: FSQKKOOTNAMONP-UHFFFAOYSA-N Synonym: acemetacin,rantudil,emflex,acemetacinum,acemix,acemetacina,acemetacine,aximeixin,rheumibis,indomethacin carboxymethyl ester PubChem CID: 1981 ChEBI: CHEBI:31162 IUPAC Name: 2-[2-[1-(4-chlorobenzoyl)-5-methoxy-2-methylindol-3-yl]acetyl]oxyacetic acid SMILES: CC1=C(C2=C(N1C(=O)C3=CC=C(C=C3)Cl)C=CC(=C2)OC)CC(=O)OCC(=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
Trimethylboroxine, 50% w/w soln. in THF
CAS: 823-96-1 Molecular Formula: C3H9B3O3 Molecular Weight (g/mol): 125.53 MDL Number: MFCD00013354 InChI Key: GBBSAMQTQCPOBF-UHFFFAOYSA-N Synonym: trimethylboroxine,2,4,6-trimethylboroxin,trimethylboroxin,boroxin, trimethyl,trimethyl-1,3,5,2,4,6-trioxatriborinane,trimethyboroxine,trimethyl boroxin,trimethylboroxaine,trimethyl boroxine,trimethyl-boroxine PubChem CID: 574072 IUPAC Name: 2,4,6-trimethyl-1,3,5,2,4,6-trioxatriborinane SMILES: CB1OB(C)OB(C)O1
3-Amino-5-bromo-2-hydroxypyridine, 95%, Thermo Scientific Chemicals
CAS: 98786-86-8 Molecular Formula: C5H5BrN2O Molecular Weight (g/mol): 189.01 MDL Number: MFCD03840438 InChI Key: ULOVLVWNSQNABA-UHFFFAOYSA-N Synonym: 3-amino-5-bromopyridin-2-ol,3-amino-5-bromo-2-hydroxypyridine,2-hydroxy-3-amino-5-bromopyridine,3-amino-5-bromopyridin-2 1h-one,3-amino-5-bromo-2-pyridinol,3-amino-5-bromo-pyridin-2-ol,2 1h-pyridinone, 3-amino-5-bromo,pubchem6513,pubchem18742,acmc-20a0ks PubChem CID: 13434515 IUPAC Name: 3-amino-5-bromo-1H-pyridin-2-one SMILES: NC1=CC(Br)=CNC1=O
7-Ethoxyresorufin, Thermo Scientific Chemicals
CAS: 5725-91-7 Molecular Formula: C14H11NO3 Molecular Weight (g/mol): 241.246 MDL Number: MFCD00037661 InChI Key: CRCWUBLTFGOMDD-UHFFFAOYSA-N Synonym: 7-ethoxyresorufin,ethoxyresorufin,resorufin ethyl ether,7-ethoxy-3h-phenoxazin-3-one,7-ethoxyphenoxazone,3h-phenoxazin-3-one, 7-ethoxy,o7-ethylresorufin,3h-phenoxazin-3-one,7-ethoxy,7-ethoxy resorufin,7-ethoxy-3-phenoxazinone PubChem CID: 3294 ChEBI: CHEBI:34480 IUPAC Name: 7-ethoxyphenoxazin-3-one SMILES: CCOC1=CC2=C(C=C1)N=C3C=CC(=O)C=C3O2
2-Amino-4-fluorobenzeneboronic acid pinacol ester, 96%
CAS: 1309982-16-8 Molecular Formula: C12H17BFNO2 Molecular Weight (g/mol): 237.081 InChI Key: URCVTWMYLLPYQY-UHFFFAOYSA-N Synonym: 5-fluoro-2-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl aniline,5-fluoro-2-4,4,5,5-tetramethyl-1,3,2 dioxaborolan-2-yl-phenylamine,5-fluoro-2-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl benzenamine,2-amino-4-fluorobenzeneboronic acid pinacol ester,2-amino-4-fluorophenylboronic acid pinacol ester,5-fluoro-2-tetramethyl-1,3,2-dioxaborolan-2-yl aniline,5-fluoro-2-4,4,5,5-tetramethyl-1,3,2 dioxaborolan-2-yl aniline,benzenamine, 5-fluoro-2-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl PubChem CID: 46864093 IUPAC Name: 5-fluoro-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)aniline SMILES: B1(OC(C(O1)(C)C)(C)C)C2=C(C=C(C=C2)F)N
1-Ethyl-3-methylimidazolium thiocyanate, 98%, Thermo Scientific Chemicals
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-]
4-Hydroxyquinoline-2-carboxylic acid, hydrate, 98%
CAS: 345909-35-5 Molecular Formula: C10H7NO3 Molecular Weight (g/mol): 189.17 MDL Number: MFCD00149476 InChI Key: HCZHHEIFKROPDY-UHFFFAOYSA-N Synonym: 4-hydroxyquinoline-2-carboxylic acid hydrate,kynurenic acid hydrate,kynurenic acid monohydrate,4-hydroxyquinaldic acid hydrate,c10h7no3.h2o,2-carboxy-4-hydroxyquinoline hydrate,4-hydroxyquinoline-2-carboxylic acid, hydrate,4-hydroxyquinoline-2-carboxylic acid,hydrate,98,4-hydroxy-2-quinolinecarboxylic acid hydrate 1:1 PubChem CID: 18530299 IUPAC Name: 4-oxo-1H-quinoline-2-carboxylic acid;hydrate SMILES: OC(=O)C1=NC2=CC=CC=C2C(O)=C1
5-Cyanoindole, 99%
CAS: 15861-24-2 Molecular Formula: C9H6N2 Molecular Weight (g/mol): 142.16 MDL Number: MFCD00005669 InChI Key: YHYLDEVWYOFIJK-UHFFFAOYSA-N Synonym: 5-cyanoindole,indole-5-carbonitrile,5-cyano indole,5-cyano-1h-indole,indole-5-cyano,5-indolecarbonitrile,5-cyano-indole,indol-5-carbonitrile,indole, 5-cyano,pubchem7326 PubChem CID: 27513 IUPAC Name: 1H-indole-5-carbonitrile SMILES: C1=CC2=C(C=CN2)C=C1C#N
4-Amino-3-bromopyridine, 98%, Thermo Scientific Chemicals
CAS: 13534-98-0 Molecular Formula: C5H5BrN2 Molecular Weight (g/mol): 173.01 MDL Number: MFCD02068297 InChI Key: DDQYSZWFFXOXER-UHFFFAOYSA-N Synonym: 4-amino-3-bromopyridine,3-bromo-4-pyridinamine,3-bromo-4-aminopyridine,3-bromo-4-pyridineamine,4-pyridinamine, 3-bromo,3-bromo-4-pyridylamine,3-bromo-4-pyridinylamine,3-bromo-pyridin-4-ylamine,pubchem1242,acmc-1bnz6 PubChem CID: 26095 IUPAC Name: 3-bromopyridin-4-amine SMILES: C1=CN=CC(=C1N)Br
2-Benzothienylboronic acid, 98%
CAS: 98437-23-1 Molecular Formula: C8H7BO2S Molecular Weight (g/mol): 178.01 MDL Number: MFCD01075674 InChI Key: YNCYPMUJDDXIRH-UHFFFAOYSA-N Synonym: 2-benzothienylboronic acid,benzo b thiophen-2-ylboronic acid,benzo b thiophene-2-boronic acid,benzothiophene-2-boronic acid,1-benzothien-2-ylboronic acid,thianaphthene-2-boronic acid,benzo b thiophene-2-ylboronic acid,2-benzothiopheneboronic acid,benzothiophen-2-ylboronic acid PubChem CID: 2359 IUPAC Name: 1-benzothiophen-2-ylboronic acid SMILES: OB(O)C1=CC2=CC=CC=C2S1