Organoheterocyclic compounds

1,2-Dimethyl-1H-imidazole-5-carbaldehyde, ≥97%, Thermo Scientific™

CAS: 24134-12-1 Molecular Formula: C6H8N2O Molecular Weight (g/mol): 124.143 MDL Number: MFCD06589827 InChI Key: XEMFQOKIINBGDI-UHFFFAOYSA-N PubChem CID: 3159610 IUPAC Name: 2,3-dimethylimidazole-4-carbaldehyde SMILES: CC1=NC=C(N1C)C=O

3-Amino-2,4-difluorobenzeneboronic acid pinacol ester, 96%

CAS: 1315692-91-1 Molecular Formula: C12H16BF2NO2 Molecular Weight (g/mol): 255.072 MDL Number: MFCD22419270 InChI Key: MQGLBRAIKSVSIT-UHFFFAOYSA-N Synonym: 3-amino-2,4-difluorobenzeneboronic acid pinacol ester,2,6-difluoro-3-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl aniline,3-amino-2,4-difluorobenzeneboronicacidpinacolester,2,6-difluoro-3-4,4,5,5-tetramethyl-1,3,2-dioxaborolane-2-yl aniline PubChem CID: 99738339 IUPAC Name: 2,6-difluoro-3-(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)F

1-Benzothiophene-2-sulfonyl chloride, 97%, Thermo Scientific™

Nalidixic acid sodium salt

CAS: 5-8-3374 Molecular Formula: C12H11N2NaO3 Molecular Weight (g/mol): 254.22 InChI Key: ROKRAUFZFDQWLE-UHFFFAOYSA-M IUPAC Name: sodium 1-ethyl-7-methyl-4-oxo-1,4-dihydro-1,8-naphthyridine-3-carboxylate SMILES: [Na+].CCN1C=C(C([O-])=O)C(=O)C2=CC=C(C)N=C12

N,N'-Di-BOC-1H-pyrazole-1-carboxamidine, 98%

CAS: 152120-54-2 Molecular Formula: C₁₄H₂₂N₄O₄ Molecular Weight (g/mol): 310.35 InChI Key: QFNFDHNZVTWZED-UHFFFAOYSA-N Synonym: n,n'-di-boc-1h-pyrazole-1-carboxamidine,bis-boc-pyrazolocarboxamidine,pyrazol boc 2,n,n-bis-boc-1-guanylpyrazole,n,n'-bis-boc-1-guanylpyrazol,n,n'-bis-boc-1-guanylpyrazole,n,n'-bisboc-pyrazole-1-carboximidamide,tert-butyl tert-butoxycarbonyl amino 1h-pyrazol-1-yl methylene carbamate,tert-butyl boc-amino 1h-pyrazol-1-yl methylene carbamate,1-n,n'-di-boc amidino pyrazole PubChem CID: 6383521 IUPAC Name: tert-butyl (NZ)-N-[[(2-methylpropan-2-yl)oxycarbonylamino]-pyrazol-1-ylmethylidene]carbamate SMILES: CC(C)(C)OC(=O)NC(=NC(=O)OC(C)(C)C)N1C=CC=N1

1,2:5,6-Di-O-isopropylidene-alpha-D-allo-furanose, 98%, Thermo Scientific Chemicals

CAS: 2595-05-3 Molecular Formula: C₁₂H₂₀O₆ Molecular Weight (g/mol): 260.28 MDL Number: MFCD00135634 InChI Key: KEJGAYKWRDILTF-VVULQXIFSA-N Synonym: 1,2:5,6-di-o-isopropylidene-alpha-d-allofuranose,3ar,5s,6r,6ar-5-r-2,2-dimethyl-1,3-dioxolan-4-yl-2,2-dimethyltetrahydrofuro 2,3-d 1,3 dioxol-6-ol,1,2,5,6-di-o-isopropylidene-alpha-d-allofuranose,3ar,5s,6r,6ar-5-4r-2,2-dimethyl-1,3-dioxolan-4-yl-2,2-dimethyl-tetrahydrofuro 2,3-d 1,3 dioxol-6-ol,1,2:5,6-bis-o-1-methylethylidene,5,6-di-o-isopropylidene-alpha-d-allofuranose,1,2:5,6-di-o-isopropylidene-?-d-allofuranose,1,2:5,6-di-o-isopropylidene-alpha-d-ribo-hexofuranose,1-o,2-o:5-o,6-o-diisopropylidene-alpha-d-allofuranose PubChem CID: 7157054 IUPAC Name: (3aR,5S,6R,6aR)-5-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-6-ol SMILES: CC1(OCC(O1)C2C(C3C(O2)OC(O3)(C)C)O)C

1-(2,4-Dimethylphenyl)piperazine, 99%, Thermo Scientific™

CAS: 1013-76-9 Molecular Formula: C₁₂H₁₈N₂ Molecular Weight (g/mol): 190.29 MDL Number: MFCD00023127 InChI Key: RUIMBVCRNZHCRQ-UHFFFAOYSA-N Synonym: 1-2,4-dimethylphenyl piperazine,1-2,4-xylyl piperazine,piperazine, 1-2,4-dimethylphenyl,2,4-dimethylphenyl piperazine,1-2,4-dimethylphenyl piperazin,pubchem8588,akos bb-5739,timtec-bb sbb003650,4-dimethylphenyl piperazine,acmc-2097uz PubChem CID: 70544 IUPAC Name: 1-(2,4-dimethylphenyl)piperazine SMILES: CC1=CC(=C(C=C1)N2CCNCC2)C

1,4-Benzodioxane-6-boronic acid, 97%

CAS: 164014-95-3 Molecular Formula: C8H9BO4 Molecular Weight (g/mol): 179.966 MDL Number: MFCD01009696 InChI Key: SQDUGGGBJXULJR-UHFFFAOYSA-N Synonym: 1,4-benzodioxane-6-boronic acid,2,3-dihydrobenzo b 1,4 dioxin-6-yl boronic acid,3,4-ethylenedioxy benzeneboronic acid,2,3-dihydro-1,4-benzodioxin-6-ylboranediol,boronic acid, 2,3-dihydro-1,4-benzodioxin-6-yl,1,4-benzodioxan-6-boronic acid,2,3-dihydro-1,4-benzodioxin-6-yl boronic acid,2,3-dihydrobenzo b 1,4 dioxin-6-ylboronic acid,1,4-benzodioxan-6-yl boronic acid PubChem CID: 2776178 IUPAC Name: 2,3-dihydro-1,4-benzodioxin-6-ylboronic acid SMILES: B(C1=CC2=C(C=C1)OCCO2)(O)O

1-(3-Chloro-2-pyridyl)piperazine, 98%

CAS: 87394-55-6 Molecular Formula: C9H12ClN3 Molecular Weight (g/mol): 197.666 MDL Number: MFCD08061034 InChI Key: HLCPXCHNWZGOMT-UHFFFAOYSA-N Synonym: 1-3-chloropyridin-2-yl piperazine,1-3-chloro-2-pyridyl piperazine,1-3-chloro-pyridin-2-yl-piperazine,1-3-chloro-2-pyridinyl piperazine,acmc-20apbr,3-chloro-2-pyridyl piperazine,n 3-chloropyridin-2-yl-piperazine,n-3-chloropyridin-2-yl-piperazine,piperazine,1-3-chloro-2-pyridinyl PubChem CID: 11412944 IUPAC Name: 1-(3-chloropyridin-2-yl)piperazine SMILES: C1CN(CCN1)C2=C(C=CC=N2)Cl

5-Methylthiophene-2-sulfonyl chloride, 97%, Thermo Scientific™

CAS: 55854-45-0 Molecular Formula: C5H5ClO2S2 Molecular Weight (g/mol): 196.66 MDL Number: MFCD05864499 InChI Key: QGGRRHYGHGJEKP-UHFFFAOYSA-N Synonym: 5-methyl-2-thiophenesulfonyl chloride,2-thiophenesulfonyl chloride, 5-methyl,5-methylthiophene-2-sulfonylchloride,5-methylthiophene-2-sulphonyl chloride,5-methyl-2-thienylsulfonyl chloride,chloro 5-methyl 2-thienyl sulfone,acmc-209lpu,5-methylthiophenesulphonyl chloride,5-methyl-thiophenesulfonyl chloride,2-chlorosulphonyl-5-methylthiophene PubChem CID: 12400112 IUPAC Name: 5-methylthiophene-2-sulfonyl chloride SMILES: CC1=CC=C(S1)S(Cl)(=O)=O

2-(2-Fluorophenyl)pyrrolidine, 95%

CAS: 72216-04-7 Molecular Formula: C10H12FN Molecular Weight (g/mol): 165.211 MDL Number: MFCD02663474 InChI Key: NOJCVVKIBLHAGW-UHFFFAOYSA-N Synonym: 2-2-fluorophenyl pyrrolidine,2-2-fluorophenyl-pyrrolidine,pyrrolidine,2-2-fluorophenyl,rs-2-2-fluoro-phenyl-pyrrolidine PubChem CID: 3613306 IUPAC Name: 2-(2-fluorophenyl)pyrrolidine SMILES: C1CC(NC1)C2=CC=CC=C2F

4-(Piperidin-1-ylmethyl)benzonitrile, ≥97%, Thermo Scientific™

CAS: 727733-92-8 Molecular Formula: C13H16N2 Molecular Weight (g/mol): 200.285 MDL Number: MFCD06796182 InChI Key: JOGVBKNLRQCYKS-UHFFFAOYSA-N Synonym: 4-piperidin-1-ylmethyl benzonitrile,1-4-cyanobenzyl piperidine,4-piperidinomethyl benzonitrile,4-piperidylmethyl benzenecarbonitrile,4-piperidin-1-ylmethyl-benzonitrile,benzonitrile,4-1-piperidinylmethyl PubChem CID: 7537603 IUPAC Name: 4-(piperidin-1-ylmethyl)benzonitrile SMILES: C1CCN(CC1)CC2=CC=C(C=C2)C#N

2-(5-Methyl-2-phenyl-1,3-oxazol-4-yl)ethan-1-ol, 97%, Thermo Scientific™

CAS: 103788-65-4 Molecular Formula: C12H13NO2 Molecular Weight (g/mol): 203.241 MDL Number: MFCD00100006 InChI Key: JYWHQBLLIBQGCU-UHFFFAOYSA-N PubChem CID: 725585 IUPAC Name: 2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)ethanol SMILES: CC1=C(N=C(O1)C2=CC=CC=C2)CCO

3-Amino-4-iodo-1H-indazole, 95%, Thermo Scientific™

CAS: 599191-73-8 Molecular Formula: C7H6IN3 Molecular Weight (g/mol): 259.05 MDL Number: MFCD03426697 InChI Key: OEQIVIYSUJXCFG-UHFFFAOYSA-N Synonym: 4-iodo-1h-indazol-3-ylamine,3-amino-4-iodo-1h-indazole,1h-indazol-3-amine, 4-iodo,3-amino-4-iodoindazole,4-iodo-1h-indazol-amine,ksc268o0n,4-iodo-1h-indazole-3-amine,4-iodo-1h-indazole-3-ylamine,3-amino-4-iodo-indazole PubChem CID: 4057787 IUPAC Name: 4-iodo-1H-indazol-3-amine SMILES: NC1=NNC2=CC=CC(I)=C12

4-Hydroxy-2-methylquinoline, 98+%

CAS: 607-67-0 Molecular Formula: C10H9NO Molecular Weight (g/mol): 159.19 MDL Number: MFCD00006758,MFCD00518775 InChI Key: NWINIEGDLHHNLH-UHFFFAOYSA-N Synonym: 2-methylquinolin-4-ol,4-hydroxy-2-methylquinoline,2-methyl-4-quinolinol,4-quinolinol, 2-methyl,4-hydroxyquinaldine,2-methyl-4-hydroxyquinoline,2-methyl-quinolin-4-ol,2-methylquinolin-4 1h-one,2-methyl-4 1h-quinolinone,2-methyl-1,4-dihydroquinolin-4-one PubChem CID: 69089 SMILES: CC1=CC(=O)C2=CC=CC=C2N1