Organoheterocyclic compounds
3-(Dimethylaminomethyl)-5-nitroindole, 95%, Thermo Scientific Chemicals
CAS: 3414-64-0 Molecular Formula: C11H13N3O2 Molecular Weight (g/mol): 219.244 MDL Number: MFCD00544197 InChI Key: SVNVKGIWGOHXPW-UHFFFAOYSA-N Synonym: 5-nitrogramine,n,n-dimethyl-1-5-nitro-1h-indol-3-yl methanamine,1h-indole-3-methanamine, n,n-dimethyl-5-nitro,indole, 3-dimethylamino methyl-5-nitro,3-dimethylamino methyl-5-nitroindole,dimethyl 5-nitro-1h-indol-3-yl methyl amine,4-22-00-04317 beilstein handbook reference,3-dimethylaminomethyl-5-nitroindole,1h-indole-3-methanamine,n-dimethyl-5-nitro PubChem CID: 18882 IUPAC Name: N,N-dimethyl-1-(5-nitro-1H-indol-3-yl)methanamine SMILES: CN(C)CC1=CNC2=C1C=C(C=C2)[N+](=O)[O-]
3-Oxetanol, 95%
CAS: 7748-36-9 Molecular Formula: C3H6O2 Molecular Weight (g/mol): 74.08 MDL Number: MFCD09056790 InChI Key: QMLWSAXEQSBAAQ-UHFFFAOYSA-N Synonym: 3-hydroxyoxetane,3-oxetanol,1,3-epoxy-2-propanol,oxetane-3-ol,3-hydroxy-oxetane,3-hydroxy oxetane,pubchem17367,ksc380k3t,1,3-epoxypropan-2-ol PubChem CID: 9942117 IUPAC Name: oxetan-3-ol SMILES: OC1COC1
1-Aminobenzotriazole, 98%
CAS: 1614-12-6 Molecular Formula: C6H6N4 Molecular Weight (g/mol): 134.14 MDL Number: MFCD00132902 InChI Key: JCXKHYLLVKZPKE-UHFFFAOYSA-N Synonym: 1-aminobenzotriazole,1h-benzotriazol-1-amine,1h-benzo d 1,2,3 triazol-1-amine,1-benzotriazolamine,1-abtz,1h-1,2,3-benzotriazol-1-amine,1h-1,2,3-benzotriazol-1-ylamine,1,2,3-benzotriazol-1-amine,benzotriazolylamine,1-benzotriazolylamine PubChem CID: 1367 IUPAC Name: benzotriazol-1-amine SMILES: C1=CC=C2C(=C1)N=NN2N
1-Boc-5-methoxyindole-2-boronic acid, 95%
CAS: 290331-71-4 Molecular Formula: C14H18BNO5 Molecular Weight (g/mol): 291.11 MDL Number: MFCD04039006 InChI Key: PZLVPMBCKHDVKT-UHFFFAOYSA-N Synonym: 1-tert-butoxycarbonyl-5-methoxy-1h-indol-2-ylboronic acid,n-boc-5-methoxy-2-indolylboronic acid,1-boc-5-methoxyindole-2-boronic acid,1-tert-butoxycarbonyl-5-methoxy-1h-indol-2-yl boronic acid,n-boc-5-methoxyindole-2-boronic acid,1-boc-5-methoxy-1h-indole-2-boronic acid,1-tert-butoxycarbonyl-5-methoxyindol-2-ylboronic acid,pubchem24022,acmc-1cjok PubChem CID: 2794716 IUPAC Name: [5-methoxy-1-[(2-methylpropan-2-yl)oxycarbonyl]indol-2-yl]boronic acid SMILES: COC1=CC=C2N(C(=O)OC(C)(C)C)C(=CC2=C1)B(O)O
4-Thiouracil, 97%, Thermo Scientific Chemicals
CAS: 591-28-6 Molecular Formula: C4H4N2OS Molecular Weight (g/mol): 128.15 MDL Number: MFCD00090842 InChI Key: OVONXEQGWXGFJD-UHFFFAOYSA-N Synonym: 4-thiouracil,2-hydroxy-4 1h-pyrimidinethione,4-thioxo-3,4-dihydropyrimidin-2 1h-one,2-hydroxy-4-mercaptopyrimidine,uracil, 4-thio,4-mercaptopyrimidin-2-ol,4-sulfanylpyrimidin-2-ol,2-hydroxy-4-thiopyrimidine,2 1h-pyrimidinone, 3,4-dihydro-4-thioxo,2 1h-pyrimidinone, 4-mercapto-9ci PubChem CID: 2734394 IUPAC Name: 4-sulfanylidene-1,2,3,4-tetrahydropyrimidin-2-one SMILES: O=C1NC=CC(=S)N1
2,2-Dimethyl-6-nitro-2H-1,4-benzoxazin-3(4H)-one, 97%, Thermo Scientific Chemicals
CAS: 85160-84-5 Molecular Formula: C10H10N2O4 Molecular Weight (g/mol): 222.20 MDL Number: MFCD03427729 InChI Key: YKXZRZGZJZYBBH-UHFFFAOYSA-N Synonym: 2,2-dimethyl-6-nitro-2h-benzo b 1,4 oxazin-3 4h-one,2h-1,4-benzoxazin-3 4h-one, 2,2-dimethyl-6-nitro,2,2-dimethyl-6-nitro-2h-1,4-benzoxazin-3 4h-one,2,2-dimethyl-6-nitro-4h-benzo 1,4 oxazin-3-one,2,2-dimethyl-6-nitro-2,3-dihydro-4h-1,4-benzooxazine-3-one,3,4-dihydro-2,2-dimethyl-6-nitro-3-oxo-2h-1,4-benzoxazine,2,2-dimethyl-6-nitro-2h-benzo b 1.4 oxazine-3 4h-one,2,2-dimethyl-6-nitro-3,4-dihydro-2h-benzo 1,4 oxazine-one PubChem CID: 10656631 IUPAC Name: 2,2-dimethyl-6-nitro-4H-1,4-benzoxazin-3-one SMILES: CC1(C)OC2=C(NC1=O)C=C(C=C2)[N+]([O-])=O
4-Fluoro-2-nitrobenzeneboronic acid pinacol ester, 96%, Thermo Scientific Chemicals
CAS: 1288978-82-4 Molecular Formula: C12H15BFNO4 Molecular Weight (g/mol): 267.06 MDL Number: MFCD16996295 InChI Key: UEMDKWBOUAQJJU-UHFFFAOYSA-N PubChem CID: 71744276 IUPAC Name: 2-(4-fluoro-2-nitrophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane SMILES: CC1(C)OB(OC1(C)C)C1=C(C=C(F)C=C1)[N+]([O-])=O
4-(2-Bromoethoxy)benzeneboronic acid pinacol ester, 98%, Thermo Scientific Chemicals
CAS: 913836-27-8 Molecular Formula: C14H20BBrO3 Molecular Weight (g/mol): 327.03 MDL Number: MFCD09027285 InChI Key: NTTOMYNPPZBRBG-UHFFFAOYSA-N Synonym: 2-4-2-bromoethoxy phenyl-4,4,5,5-tetramethyl-1,3,2-dioxaborolane,4-2-bromoethoxy phenylboronic acid, pinacol ester,4-2-bromoethoxy benzeneboronic acid, pinacol ester,1,3,2-dioxaborolane,2-4-2-bromoethoxy phenyl-4,4,5,5-tetramethyl PubChem CID: 44119155 IUPAC Name: 2-[4-(2-bromoethoxy)phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane SMILES: CC1(C)OB(OC1(C)C)C1=CC=C(OCCBr)C=C1
4-(6-Amino-3-pyridyl)-1-Boc-piperazine, 97%
CAS: 571188-59-5 Molecular Formula: C14H22N4O2 Molecular Weight (g/mol): 278.36 MDL Number: MFCD11594962 InChI Key: RMULRXHUNOVPEI-UHFFFAOYSA-N PubChem CID: 11737525 IUPAC Name: tert-butyl 4-(6-aminopyridin-3-yl)piperazine-1-carboxylate SMILES: CC(C)(C)OC(=O)N1CCN(CC1)C1=CN=C(N)C=C1
3-Bromomethyl-3-oxetanemethanol, 95%
CAS: 22633-44-9 Molecular Formula: C5H9BrO2 Molecular Weight (g/mol): 181.03 MDL Number: MFCD09800598 InChI Key: SESXZSLSTRITGO-UHFFFAOYSA-N PubChem CID: 529264 IUPAC Name: [3-(bromomethyl)oxetan-3-yl]methanol SMILES: OCC1(CBr)COC1
4-(4-Acetyl-1-piperazinyl)benzeneboronic acid pinacol ester, 95%, Thermo Scientific Chemicals
CAS: 1218791-38-8 Molecular Formula: C18H27BN2O3 Molecular Weight (g/mol): 330.235 MDL Number: MFCD13195756 InChI Key: VRZVSHHLWMAHAZ-UHFFFAOYSA-N Synonym: 4-4-acetyl-1-piperazinyl phenylboronic acid pinacol ester,1-4-4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl phenyl piperazin-1-yl ethanone,4-4-acetylpiperazino phenylboronic acid pinacol ester,1-4-4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl phenyl-1-piperazinyl ethanone,4-4-acetyl-1-piperazinyl phenylboronicacidpinacolester,4-4-acetylpiperazino phenylboronic acid, pinacol ester,4-4-acetyl-1-piperazinyl benzeneboronic acid pinacol ester,1-4-4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl phenyl piperazin-1-yl ethan-1-one PubChem CID: 53217141 IUPAC Name: 1-[4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]piperazin-1-yl]ethanone SMILES: B1(OC(C(O1)(C)C)(C)C)C2=CC=C(C=C2)N3CCN(CC3)C(=O)C
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
5-Amino-2-(hydroxymethyl)benzeneboronic acid hemiester hydrochloride, 95%
CAS: 117098-93-8 Molecular Formula: C7H9BClNO2 Molecular Weight (g/mol): 185.41 MDL Number: MFCD04115645 InChI Key: ZDCBDYGPSUVCOU-UHFFFAOYSA-N Synonym: 6-aminobenzo c 1,2 oxaborol-1 3h-ol hydrochloride,6-amino-1-hydroxy-2,1-benzoxaborolane hydrochloride,5-amino-2-hydroxymethylphenylboronic acid, hcl, dehydrate,5-amino-2-hydroxymethylphenyl boronic acid, hcl, dehydrate,6-amino-3h-2,1-benzoxaborol-1-ol hydrochloride,1-hydroxy-3h-2,1-benzoxaborol-6-amine hydrochloride,5-amino-2-hydroxymethylphenyl boronic acid, hydrochloride, dehydrate,6-amino-1-hydroxy-2,1-benzoxaborolane, hcl,6-amino-2,1-benzoxaborol-1 3h-ol-hydrogen chloride 1/1,5-amino-2-hydroxymethylphenyl boronicacid, hcl, dehydrate PubChem CID: 44118730 IUPAC Name: 1-hydroxy-3H-2,1-benzoxaborol-6-amine;hydrochloride SMILES: Cl.NC1=CC2=C(COB2O)C=C1
3,6-Dibromocarbazole, 99%
CAS: 6825-20-3 Molecular Formula: C12H7Br2N Molecular Weight (g/mol): 325.003 MDL Number: MFCD00004961 InChI Key: FIHILUSWISKVSR-UHFFFAOYSA-N Synonym: 3,6-dibromocarbazole,9h-carbazole, 3,6-dibromo,carbazole, 3,6-dibromo,pubchem9951,3,6-dibromo-carbazole,acmc-209o2m,3,6,-dibromo-9h-carbazole,3,6-dibromo-9-h-carbazole,ksc490o8t PubChem CID: 274874 IUPAC Name: 3,6-dibromo-9H-carbazole SMILES: C1=CC2=C(C=C1Br)C3=C(N2)C=CC(=C3)Br
1-(Benzyloxycarbonyl)piperazine, 98%
CAS: 31166-44-6 Molecular Formula: C12H17N2O2 Molecular Weight (g/mol): 221.28 MDL Number: MFCD00274317 InChI Key: CTOUWUYDDUSBQE-UHFFFAOYSA-O Synonym: 1-cbz-piperazine,benzyl 1-piperazinecarboxylate,1-benzyloxycarbonyl piperazine,1-carbobenzoxypiperazine,n-cbz-piperazine,1-z-piperazine,1-piperazinecarboxylic acid, phenylmethyl ester,piperazine-1-carboxylic acid benzyl ester,phenylmethyl piperazinecarboxylate,cbz-piperazine PubChem CID: 643495 IUPAC Name: benzyl piperazine-1-carboxylate SMILES: O=C(OCC1=CC=CC=C1)N1CC[NH2+]CC1