Organoheterocyclic compounds
2-(Dimethylcarbamoyl)pyridine-5-boronic acid pinacol ester, 96%
CAS: 1006876-27-2 Molecular Formula: C14H21BN2O3 Molecular Weight (g/mol): 276.143 MDL Number: MFCD08458484 InChI Key: RNCGUUHRBRONRG-UHFFFAOYSA-N Synonym: n,n-dimethyl-5-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl picolinamide,6-dimethylcarbamoyl pyridin-3-ylboronic acid pinacol ester,n,n-dimethyl-5-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl pyridine-2-carboxamide,6-dimethylcarbamoyl pyridine-3-boronic acid pinacol ester,2-dimethylcarbamoyl pyridine-5-boronic acid pinacol ester,n,n-dimethyl-5-tetramethyl-1,3,2-dioxaborolan-2-yl pyridine-2-carboxamide,2-n,n-dimthylaminocarbonyl pyridine-5-boronic acid pinacol ester,n,n-dimethyl-5-4,4,5,5-tetramethyl-1,3,2 dioxaborolan-2-yl picolinamide,2-pyridinecarboxamide, n,n-dimethyl-5-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl,n,n-dimethyl-5-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl-2-pyridinecarboxamide PubChem CID: 57416491 IUPAC Name: N,N-dimethyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-2-carboxamide SMILES: B1(OC(C(O1)(C)C)(C)C)C2=CN=C(C=C2)C(=O)N(C)C
Trimethoxyboroxine
CAS: 102-24-9 Molecular Formula: C3H9B3O6 Molecular Weight (g/mol): 173.53 MDL Number: MFCD00005946 InChI Key: ZFMOJHVRFMOIGF-UHFFFAOYSA-N Synonym: trimethoxyboroxine,trimethoxyboroxin,boroxin, trimethoxy,trimethoxycyclotriboroxane,2,4,6-trimethoxyboroxin,triboron trimethyl hexaoxide,boroxin, 2,4,6-trimethoxy,boric acid h3b3o6 , trimethyl ester,trimethoxy-boroxi,trimethoxyboroxole PubChem CID: 66880 SMILES: COB1OB(OC)OB(OC)O1
2-Aminobenzothiazole, 97%
CAS: 136-95-8 Molecular Formula: C7H6N2S Molecular Weight (g/mol): 150.2 MDL Number: MFCD00005785 InChI Key: UHGULLIUJBCTEF-UHFFFAOYSA-N Synonym: 2-aminobenzothiazole,2-benzothiazolamine,benzo d thiazol-2-amine,benzothiazol-2-ylamine,2-aminobenzthiazole,benzothiazole-2-ylamine,2-iminobenzothiazoline,o-aminobenzothiazole,benzothiazole, 2-amino,2-benzothiazolylamine PubChem CID: 8706 IUPAC Name: 1,3-benzothiazol-2-amine SMILES: C1=CC=C2C(=C1)N=C(S2)N
4-Pyridineacetonitrile, ≥97%, Thermo Scientific Chemicals
CAS: 13121-99-8 Molecular Formula: C7H6N2 Molecular Weight (g/mol): 118.14 MDL Number: MFCD03412601 InChI Key: BMVSAKPRNWZCPG-UHFFFAOYSA-N Synonym: pyridin-4-yl-acetonitrile,2-pyridin-4-yl acetonitrile,4-pyridylacetonitrile,4-pyridineacetonitrile,pyridin-4-ylacetonitrile,pyridine-4-acetonitrile,rarechem ak ml 0204,2-4-pyridyl acetonitrile,4-pyridylacetonitrilehydrochloride,4-cyanomethyl-pyridine PubChem CID: 4112085 IUPAC Name: 2-pyridin-4-ylacetonitrile SMILES: N#CCC1=CC=NC=C1
2,3-Dihydro-7-azaindole, 97+%
CAS: 10592-27-5 Molecular Formula: C7H8N2 Molecular Weight (g/mol): 120.155 MDL Number: MFCD06659751 InChI Key: ZFFYPGZDXUPKNK-UHFFFAOYSA-N Synonym: 2,3-dihydro-1h-pyrrolo 2,3-b pyridine,7-azaindoline,2,3-dihydro-7-azaindole,1h,2h,3h-pyrrolo 2,3-b pyridine,1h-pyrrolo 2,3-b pyridine, 2,3-dihydro,2,3-dihydro-1h-pyrrolo 2,3-b pyridine 7-azaindoline,pubchem18022,acmc-2098hy,ksc492q5f PubChem CID: 10011889 IUPAC Name: 2,3-dihydro-1H-pyrrolo[2,3-b]pyridine SMILES: C1CNC2=C1C=CC=N2
9-Phenylcarbazole-3-boronic acid, 98%
CAS: 854952-58-2 Molecular Formula: C18H14BNO2 Molecular Weight (g/mol): 287.13 MDL Number: MFCD12196936 InChI Key: JWJQEUDGBZMPAX-UHFFFAOYSA-N Synonym: 9-phenyl-9h-carbazol-3-yl boronic acid,9-phenyl-9h-carbazol-3-ylboronic acid,9-phenyl carbazole-3-boronic acid,9-phenyl-3-carbazoleboronic acid,9-phenylcarbazole-3-boronic acid,b-9-phenyl-9h-carbazol-3-yl boronic acid,n-phenylcarbazole-3-boronic acid,3-borono-9-phenyl-9h-carbazole,pubchem23232,g00061-watson-int PubChem CID: 51358450 IUPAC Name: (9-phenylcarbazol-3-yl)boronic acid SMILES: OB(O)C1=CC2=C(C=C1)N(C1=C2C=CC=C1)C1=CC=CC=C1
4-Azaindole, 97%
CAS: 272-49-1 Molecular Formula: C7H6N2 Molecular Weight (g/mol): 118.14 MDL Number: MFCD00971977 InChI Key: XWIYUCRMWCHYJR-UHFFFAOYSA-N Synonym: 4-azaindole,1h-pyrrolo 3,2-b pyridine,1,4-diazaindene,pyrrolopyridine,4h-pyrrolo 3,2-b pyridine,1h-pyrrolo 3.2-b pyridine,zlchem 17,pubchem7675,acmc-1clkx PubChem CID: 9226 IUPAC Name: 1H-pyrrolo[3,2-b]pyridine SMILES: N1C=CC2=NC=CC=C12
4-(2-Fluoro-4-nitrophenyl)morpholine, 98%
CAS: 2689-39-6 Molecular Formula: C10H11FN2O3 Molecular Weight (g/mol): 226.21 MDL Number: MFCD03138381 InChI Key: ZEQCFSSBZPZEFJ-UHFFFAOYSA-N Synonym: 4-2-fluoro-4-nitrophenyl morpholine,morpholine, 4-2-fluoro-4-nitrophenyl,4-2-fluoro-4-nitro-phenyl-morpholine,3-fluoro-4-morpholinonitrobenzene,acmc-209gtt,cambridge id 6614516,3fluoro-4-morpholinonitrobenzene,3-fluoro-4-morpholinyl nitrobenzene,3-fluoro-4-morpholinyl-nitrobenzene,1-fluoro-2-morpholino-5-nitrobenzene PubChem CID: 2905489 IUPAC Name: 4-(2-fluoro-4-nitrophenyl)morpholine SMILES: [O-][N+](=O)C1=CC(F)=C(C=C1)N1CCOCC1
4,6-Dichloro-5-nitropyrimidine, 98%
CAS: 4316-93-2 Molecular Formula: C4HCl2N3O2 Molecular Weight (g/mol): 193.97 MDL Number: MFCD00006107 InChI Key: HCTISZQLTGAYOX-UHFFFAOYSA-N Synonym: pyrimidine, 4,6-dichloro-5-nitro,4,6-dichloro-5-nitro-pyrimidine,4,6-dichloro-5-nitro-pyridine,pubchem7078,acmc-1an8c,4-23-00-00899 beilstein handbook reference,ksc495i5h,4,6-dichloro-5-nitroprimidine,4,6 dichloro-5-nitropyrimidine,5-nitro 4,6-dichloropyrimidine PubChem CID: 20312 IUPAC Name: 4,6-dichloro-5-nitropyrimidine SMILES: [O-][N+](=O)C1=C(Cl)N=CN=C1Cl
5-Methyl-1H-benzotriazole, 98+%
CAS: 136-85-6 Molecular Formula: C7H7N3 Molecular Weight (g/mol): 133.15 MDL Number: MFCD00005702 InChI Key: LRUDIIUSNGCQKF-UHFFFAOYSA-N Synonym: 5-methyl-1h-benzotriazole,5-methylbenzotriazole,tolutriazole,5-tolyltriazole,1h-benzotriazole, 5-methyl,6-methylbenzotriazole,5-methyl-1h-benzo d 1,2,3 triazole,5-methyl-1,2,3-benzotriazole,6-methyl-1,2,3-benzotriazole,t56 bmnnj g1 PubChem CID: 8705 ChEBI: CHEBI:83455 IUPAC Name: 5-methyl-2H-benzotriazole SMILES: CC1=CC2=NNN=C2C=C1
N-Ethoxycarbonyl-2-ethoxy-1,2-dihydroquinoline, 99+%
CAS: 16357-59-8 Molecular Formula: C14H17NO3 Molecular Weight (g/mol): 247.29 MDL Number: MFCD00006703 InChI Key: GKQLYSROISKDLL-UHFFFAOYNA-N Synonym: eedq,2-ethoxy-1-ethoxycarbonyl-1,2-dihydroquinoline,n-ethoxycarbonyl-2-ethoxy-1,2-dihydroquinoline,ethyl 2-ethoxyquinoline-1 2h-carboxylate,1-ethoxycarbonyl-2-ethoxy-1,2-dihydroquinoline,2-ethoxy-1 2h-quinolinecarboxylic acid, ethyl ester,1 2h-quinolinecarboxylic acid, 2-ethoxy-, ethyl ester,ethyl 2-ethoxy-1,2-dihydroquinoline-1-carboxylate,ethyl 1,2-dihydro-2-ethoxy-1-quinolinecarboxylate,ethyl n-2-ethoxy-1,2-dihydroquinoline carboxylate PubChem CID: 27833 IUPAC Name: ethyl 2-ethoxy-2H-quinoline-1-carboxylate SMILES: CCOC1C=CC2=CC=CC=C2N1C(=O)OCC
3-(2-Furyl)acrolein, 99%
CAS: 623-30-3 Molecular Formula: C7H6O2 Molecular Weight (g/mol): 122.123 MDL Number: MFCD00003256 InChI Key: VZIRCHXYMBFNFD-HNQUOIGGSA-N Synonym: 3-2-furyl acrolein,2-furanacrolein,e-3-furan-2-yl acrylaldehyde,3-furan-2-yl acrylaldehyde,2-propenal, 3-2-furanyl,trans-3-2-furyl acrolein,beta-2-furylacrolein,3-2-furyl acrylaldehyde,unii-ssq86u3drp,furyl acrolein PubChem CID: 1549521 IUPAC Name: (E)-3-(furan-2-yl)prop-2-enal SMILES: C1=COC(=C1)C=CC=O
2-Oxazolidone, 98%
CAS: 497-25-6 Molecular Formula: C3H5NO2 Molecular Weight (g/mol): 87.08 MDL Number: MFCD00005268 InChI Key: IZXIZTKNFFYFOF-UHFFFAOYSA-N Synonym: 2-oxazolidone,oxazolidin-2-one,2-oxazolidinone,oxazolidinone,oxazolidone,oxazolidinones,unii-z4d49w92pp,carbamic acid, 2-hydroxyethyl-, gamma-lactone,wln: t5mvotj,carbamic acid, .gamma.-lactone PubChem CID: 73949 ChEBI: CHEBI:1237 IUPAC Name: 1,3-oxazolidin-2-one SMILES: O=C1NCCO1
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
5-Formyl-2,4-dimethylpyrrole-3-carboxylic acid, 96%
CAS: 253870-02-9 Molecular Formula: C8H9NO3 Molecular Weight (g/mol): 167.164 MDL Number: MFCD06202342 InChI Key: YCIHQDVIAISDPS-UHFFFAOYSA-N Synonym: 5-formyl-2,4-dimethylpyrrole-3-carboxylic acid,2,4-dimethyl-5-formylpyrrole-3-carboxylic acid,3,5-dimethyl-2-formylpyrrole-4-carboxylic acid,1h-pyrrole-3-carboxylic acid, 5-formyl-2,4-dimethyl,5-formyl-2,4-dimethyl-1h-pyrrole-3-carboxylicacid,3,5-dimethyl-2-formyl-1h-pyrrole-4-carboxylic acid,3,5-dimethyl-2-formylindole-4-carboxylic acid,zlchem 714,pubchem9414,acmc-209zxq PubChem CID: 11073792 IUPAC Name: 5-formyl-2,4-dimethyl-1H-pyrrole-3-carboxylic acid SMILES: CC1=C(NC(=C1C(=O)O)C)C=O