Organoheterocyclic compounds
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2-Chloro-3-nitro-5-(trifluoromethyl)pyridine, 95%
CAS: 72587-15-6 Molecular Formula: C6H2ClF3N2O2 Molecular Weight (g/mol): 226.539 MDL Number: MFCD06255171 InChI Key: DRPIKFKCAJGTJF-UHFFFAOYSA-N Synonym: 2-chloro-3-nitro-5-trifluoromethyl pyridine,2-chloro-5-trifluoromethyl-3-nitropyridine,pyridine, 2-chloro-3-nitro-5-trifluoromethyl,5-trifluoromethyl-3-nitro-2-chloropyridine,pubchem17529,acmc-209onn,abbypharma ap-11-5568,2-chloro-3-nitro-5-trifluoromethyl-pyridine,2-chloro3-nitro-5-trifluoromethyl pyridine PubChem CID: 4736950 IUPAC Name: 2-chloro-3-nitro-5-(trifluoromethyl)pyridine SMILES: C1=C(C=NC(=C1[N+](=O)[O-])Cl)C(F)(F)F
| PubChem CID | 4736950 |
|---|---|
| CAS | 72587-15-6 |
| Molecular Weight (g/mol) | 226.539 |
| MDL Number | MFCD06255171 |
| SMILES | C1=C(C=NC(=C1[N+](=O)[O-])Cl)C(F)(F)F |
| Synonym | 2-chloro-3-nitro-5-trifluoromethyl pyridine,2-chloro-5-trifluoromethyl-3-nitropyridine,pyridine, 2-chloro-3-nitro-5-trifluoromethyl,5-trifluoromethyl-3-nitro-2-chloropyridine,pubchem17529,acmc-209onn,abbypharma ap-11-5568,2-chloro-3-nitro-5-trifluoromethyl-pyridine,2-chloro3-nitro-5-trifluoromethyl pyridine |
| IUPAC Name | 2-chloro-3-nitro-5-(trifluoromethyl)pyridine |
| InChI Key | DRPIKFKCAJGTJF-UHFFFAOYSA-N |
| Molecular Formula | C6H2ClF3N2O2 |
4-Benzyloxy-2(1H)-pyridone, 98%, Thermo Scientific Chemicals
CAS: 53937-02-3 Molecular Formula: C12H11NO2 Molecular Weight (g/mol): 201.23 MDL Number: MFCD04039771 InChI Key: DOVNUEPFPBWTSV-UHFFFAOYSA-N Synonym: 4-benzyloxy-2-1h-pyridone,4-benzyloxy-2 1h-pyridone,4-benzyloxy pyridin-2 1h-one,4-benzyloxypyridin-2-one,4-benzyloxy pyridin-2-ol,4-benzyloxy-2-hydroxypyridine,4-benzyloxy-1h-pyridin-2-one,2 1h-pyridinone, 4-phenylmethoxy,4-benzyloxy-1,2-dihydropyridin-2-one PubChem CID: 3607724 SMILES: O=C1NC=CC(OCC2=CC=CC=C2)=C1
| PubChem CID | 3607724 |
|---|---|
| CAS | 53937-02-3 |
| Molecular Weight (g/mol) | 201.23 |
| MDL Number | MFCD04039771 |
| SMILES | O=C1NC=CC(OCC2=CC=CC=C2)=C1 |
| Synonym | 4-benzyloxy-2-1h-pyridone,4-benzyloxy-2 1h-pyridone,4-benzyloxy pyridin-2 1h-one,4-benzyloxypyridin-2-one,4-benzyloxy pyridin-2-ol,4-benzyloxy-2-hydroxypyridine,4-benzyloxy-1h-pyridin-2-one,2 1h-pyridinone, 4-phenylmethoxy,4-benzyloxy-1,2-dihydropyridin-2-one |
| InChI Key | DOVNUEPFPBWTSV-UHFFFAOYSA-N |
| Molecular Formula | C12H11NO2 |
(+/-)-1-Boc-3-hydroxypyrrolidine, 97%
CAS: 103057-44-9 Molecular Formula: C9H17NO3 Molecular Weight (g/mol): 187.239 MDL Number: MFCD04038535 InChI Key: APCBTRDHCDOPNY-UHFFFAOYSA-N Synonym: 1-boc-3-hydroxypyrrolidine,1-boc-3-pyrrolidinol,n-boc-3-hydroxypyrrolidine,n-boc-3-pyrrolidinol,1-n-boc-3-hydroxypyrrolidine,1-pyrrolidinecarboxylic acid, 3-hydroxy-, 1,1-dimethylethyl ester,1-tert-butoxycarbonyl-3-pyrrolidinol,3-hydroxy-pyrrolidine-1-carboxylic acid tert-butyl ester,tert-butyl 3-hydroxypyrrolidinecarboxylate,1-tert-butoxycarbonyl-3-hydroxypyrrolidine PubChem CID: 4416939 IUPAC Name: tert-butyl 3-hydroxypyrrolidine-1-carboxylate SMILES: CC(C)(C)OC(=O)N1CCC(C1)O
| PubChem CID | 4416939 |
|---|---|
| CAS | 103057-44-9 |
| Molecular Weight (g/mol) | 187.239 |
| MDL Number | MFCD04038535 |
| SMILES | CC(C)(C)OC(=O)N1CCC(C1)O |
| Synonym | 1-boc-3-hydroxypyrrolidine,1-boc-3-pyrrolidinol,n-boc-3-hydroxypyrrolidine,n-boc-3-pyrrolidinol,1-n-boc-3-hydroxypyrrolidine,1-pyrrolidinecarboxylic acid, 3-hydroxy-, 1,1-dimethylethyl ester,1-tert-butoxycarbonyl-3-pyrrolidinol,3-hydroxy-pyrrolidine-1-carboxylic acid tert-butyl ester,tert-butyl 3-hydroxypyrrolidinecarboxylate,1-tert-butoxycarbonyl-3-hydroxypyrrolidine |
| IUPAC Name | tert-butyl 3-hydroxypyrrolidine-1-carboxylate |
| InChI Key | APCBTRDHCDOPNY-UHFFFAOYSA-N |
| Molecular Formula | C9H17NO3 |
4-Bromopyridine-2-carboxylic acid, 97%
CAS: 30766-03-1 Molecular Formula: C6H4BrNO2 Molecular Weight (g/mol): 202.007 MDL Number: MFCD03426665 InChI Key: RPHHYRNGCJYQSP-UHFFFAOYSA-N Synonym: 4-bromopicolinic acid,4-bromo-2-pyridinecarboxylic acid,4-bromo-pyridinecarboxylic acid,2-pyridinecarboxylic acid, 4-bromo,4-bromo-pyridine-2-carboxylic acid,aurora 23242,pubchem4064,acmc-209hio,ksc222g5r PubChem CID: 735150 IUPAC Name: 4-bromopyridine-2-carboxylic acid SMILES: C1=CN=C(C=C1Br)C(=O)O
| PubChem CID | 735150 |
|---|---|
| CAS | 30766-03-1 |
| Molecular Weight (g/mol) | 202.007 |
| MDL Number | MFCD03426665 |
| SMILES | C1=CN=C(C=C1Br)C(=O)O |
| Synonym | 4-bromopicolinic acid,4-bromo-2-pyridinecarboxylic acid,4-bromo-pyridinecarboxylic acid,2-pyridinecarboxylic acid, 4-bromo,4-bromo-pyridine-2-carboxylic acid,aurora 23242,pubchem4064,acmc-209hio,ksc222g5r |
| IUPAC Name | 4-bromopyridine-2-carboxylic acid |
| InChI Key | RPHHYRNGCJYQSP-UHFFFAOYSA-N |
| Molecular Formula | C6H4BrNO2 |
5-Bromo-1,2-dimethyl-1H-imidazole, ≥97%, Thermo Scientific™
CAS: 24134-09-6 Molecular Formula: C5H7BrN2 Molecular Weight (g/mol): 175.03 MDL Number: MFCD06659905 InChI Key: WIRCWIXZNDCIST-UHFFFAOYSA-N Synonym: 5-bromo-1,2-dimethyl-1h-imidazole,1h-imidazole,5-bromo-1,2-dimethyl,pubchem23641,1,2-dimethyl-5-bromo-1h-imidazole,1h-imidazole, 5-bromo-1,2-dimethyl PubChem CID: 7204879 IUPAC Name: 5-bromo-1,2-dimethylimidazole SMILES: CN1C(C)=NC=C1Br
| PubChem CID | 7204879 |
|---|---|
| CAS | 24134-09-6 |
| Molecular Weight (g/mol) | 175.03 |
| MDL Number | MFCD06659905 |
| SMILES | CN1C(C)=NC=C1Br |
| Synonym | 5-bromo-1,2-dimethyl-1h-imidazole,1h-imidazole,5-bromo-1,2-dimethyl,pubchem23641,1,2-dimethyl-5-bromo-1h-imidazole,1h-imidazole, 5-bromo-1,2-dimethyl |
| IUPAC Name | 5-bromo-1,2-dimethylimidazole |
| InChI Key | WIRCWIXZNDCIST-UHFFFAOYSA-N |
| Molecular Formula | C5H7BrN2 |
2-Amino-5-nitropyridine, 99%
CAS: 4214-76-0 Molecular Formula: C5H5N3O2 Molecular Weight (g/mol): 139.11 MDL Number: MFCD00006325 InChI Key: UGSBCCAHDVCHGI-UHFFFAOYSA-N Synonym: 2-amino-5-nitropyridine,2-pyridinamine, 5-nitro,5-nitro-2-aminopyridine,5-nitro-2-pyridinamine,2-amino-5-nitro pyridine,pyridine, 2-amino-5-nitro,5-nitro-pyridin-2-ylamine,5-nitro-pyridin-2-yl amine,5-nitro-2-pyridylamine,5-nitropyridin-2-amin PubChem CID: 77888 IUPAC Name: 5-nitropyridin-2-amine SMILES: NC1=CC=C(C=N1)[N+]([O-])=O
| PubChem CID | 77888 |
|---|---|
| CAS | 4214-76-0 |
| Molecular Weight (g/mol) | 139.11 |
| MDL Number | MFCD00006325 |
| SMILES | NC1=CC=C(C=N1)[N+]([O-])=O |
| Synonym | 2-amino-5-nitropyridine,2-pyridinamine, 5-nitro,5-nitro-2-aminopyridine,5-nitro-2-pyridinamine,2-amino-5-nitro pyridine,pyridine, 2-amino-5-nitro,5-nitro-pyridin-2-ylamine,5-nitro-pyridin-2-yl amine,5-nitro-2-pyridylamine,5-nitropyridin-2-amin |
| IUPAC Name | 5-nitropyridin-2-amine |
| InChI Key | UGSBCCAHDVCHGI-UHFFFAOYSA-N |
| Molecular Formula | C5H5N3O2 |
Thieno[2,3-b]pyridine-2-carbaldehyde, ≥97%, Thermo Scientific™
CAS: 53174-98-4 Molecular Formula: C8H5NOS Molecular Weight (g/mol): 163.194 MDL Number: MFCD07772791 InChI Key: HGZQKYOLRLVMHZ-UHFFFAOYSA-N Synonym: thieno 2,3-b pyridine-2-carbaldehyde,thieno 2,3-b pyridine-2-carboxaldehyde,2-formylthieno 2,3-b pyridine,thiopheno 2,3-b pyridine-2-carbaldehyde PubChem CID: 289925 IUPAC Name: thieno[2,3-b]pyridine-2-carbaldehyde SMILES: C1=CC2=C(N=C1)SC(=C2)C=O
| PubChem CID | 289925 |
|---|---|
| CAS | 53174-98-4 |
| Molecular Weight (g/mol) | 163.194 |
| MDL Number | MFCD07772791 |
| SMILES | C1=CC2=C(N=C1)SC(=C2)C=O |
| Synonym | thieno 2,3-b pyridine-2-carbaldehyde,thieno 2,3-b pyridine-2-carboxaldehyde,2-formylthieno 2,3-b pyridine,thiopheno 2,3-b pyridine-2-carbaldehyde |
| IUPAC Name | thieno[2,3-b]pyridine-2-carbaldehyde |
| InChI Key | HGZQKYOLRLVMHZ-UHFFFAOYSA-N |
| Molecular Formula | C8H5NOS |
4-Amino-2-picoline, 98+%, Thermo Scientific™
CAS: 18437-58-6 Molecular Formula: C6H8N2 Molecular Weight (g/mol): 108.14 MDL Number: MFCD00186509 InChI Key: GNCLPNMQEGMNTG-UHFFFAOYSA-N Synonym: 4-amino-2-methylpyridine,4-amino-2-picoline,2-methyl-4-aminopyridine,2-methyl-4-pyridinamine,4-pyridinamine, 2-methyl,2-methyl-pyridin-4-ylamine,4 1h-pyridinimine, 2-methyl,4-amino-picoline,4-amino-6-picoline,pubchem1118 PubChem CID: 728670 IUPAC Name: 2-methylpyridin-4-amine SMILES: CC1=NC=CC(=C1)N
| PubChem CID | 728670 |
|---|---|
| CAS | 18437-58-6 |
| Molecular Weight (g/mol) | 108.14 |
| MDL Number | MFCD00186509 |
| SMILES | CC1=NC=CC(=C1)N |
| Synonym | 4-amino-2-methylpyridine,4-amino-2-picoline,2-methyl-4-aminopyridine,2-methyl-4-pyridinamine,4-pyridinamine, 2-methyl,2-methyl-pyridin-4-ylamine,4 1h-pyridinimine, 2-methyl,4-amino-picoline,4-amino-6-picoline,pubchem1118 |
| IUPAC Name | 2-methylpyridin-4-amine |
| InChI Key | GNCLPNMQEGMNTG-UHFFFAOYSA-N |
| Molecular Formula | C6H8N2 |
Pyridoxine hydrochloride, 98%, MP Biomedicals™
CAS: 58-56-0 Molecular Formula: C8H12ClNO3 Molecular Weight (g/mol): 205.638 MDL Number: MFCD00012807 InChI Key: ZUFQODAHGAHPFQ-UHFFFAOYSA-N Synonym: pyridoxine hydrochloride,pyridoxine hcl,pyridoxol hydrochloride,vitamin b6,alestrol,becilan,benadon,hexavibex,hexermin,hexobion PubChem CID: 6019 ChEBI: CHEBI:30961 IUPAC Name: 4,5-bis(hydroxymethyl)-2-methylpyridin-3-ol;hydrochloride SMILES: CC1=NC=C(C(=C1O)CO)CO.Cl
| PubChem CID | 6019 |
|---|---|
| CAS | 58-56-0 |
| Molecular Weight (g/mol) | 205.638 |
| ChEBI | CHEBI:30961 |
| MDL Number | MFCD00012807 |
| SMILES | CC1=NC=C(C(=C1O)CO)CO.Cl |
| Synonym | pyridoxine hydrochloride,pyridoxine hcl,pyridoxol hydrochloride,vitamin b6,alestrol,becilan,benadon,hexavibex,hexermin,hexobion |
| IUPAC Name | 4,5-bis(hydroxymethyl)-2-methylpyridin-3-ol;hydrochloride |
| InChI Key | ZUFQODAHGAHPFQ-UHFFFAOYSA-N |
| Molecular Formula | C8H12ClNO3 |
Thianaphthene, 97%
CAS: 95-15-8 Molecular Formula: C8H6S Molecular Weight (g/mol): 134.2 MDL Number: MFCD00005864 InChI Key: FCEHBMOGCRZNNI-UHFFFAOYSA-N Synonym: benzo b thiophene,thianaphthene,benzothiophene,benzothiofuran,thionaphthene,1-thiaindene,thianaphthen,benzothiophen,thianaphtene,1-benzothiophen PubChem CID: 7221 ChEBI: CHEBI:35858 IUPAC Name: 1-benzothiophene SMILES: C1=CC=C2C(=C1)C=CS2
| PubChem CID | 7221 |
|---|---|
| CAS | 95-15-8 |
| Molecular Weight (g/mol) | 134.2 |
| ChEBI | CHEBI:35858 |
| MDL Number | MFCD00005864 |
| SMILES | C1=CC=C2C(=C1)C=CS2 |
| Synonym | benzo b thiophene,thianaphthene,benzothiophene,benzothiofuran,thionaphthene,1-thiaindene,thianaphthen,benzothiophen,thianaphtene,1-benzothiophen |
| IUPAC Name | 1-benzothiophene |
| InChI Key | FCEHBMOGCRZNNI-UHFFFAOYSA-N |
| Molecular Formula | C8H6S |
6-Bromopyridine-2-carboxamide, 97%
CAS: 25194-52-9 Molecular Formula: C6H5BrN2O Molecular Weight (g/mol): 201.02 MDL Number: MFCD00234154 InChI Key: HWRUOHMDYQEWOD-UHFFFAOYSA-N PubChem CID: 21961408 IUPAC Name: 6-bromopyridine-2-carboxamide SMILES: NC(=O)C1=NC(Br)=CC=C1
| PubChem CID | 21961408 |
|---|---|
| CAS | 25194-52-9 |
| Molecular Weight (g/mol) | 201.02 |
| MDL Number | MFCD00234154 |
| SMILES | NC(=O)C1=NC(Br)=CC=C1 |
| IUPAC Name | 6-bromopyridine-2-carboxamide |
| InChI Key | HWRUOHMDYQEWOD-UHFFFAOYSA-N |
| Molecular Formula | C6H5BrN2O |
N-(Benzyloxycarbonyloxy)succinimide, 98%
CAS: 13139-17-8 Molecular Formula: C12H11NO5 Molecular Weight (g/mol): 249.22 MDL Number: MFCD00005513 InChI Key: MJSHDCCLFGOEIK-UHFFFAOYSA-N Synonym: n-benzyloxycarbonyloxy succinimide,cbz-osu,cbz-onsu,benzyl 2,5-dioxopyrrolidin-1-yl carbonate,benzyl succinimido carbonate,z-osu,n-carbobenzoxyoxysuccinimide,n-benzyloxycarbonyloxy-succinimide,cbzosu,carbobenzoxy succinimide PubChem CID: 83172 IUPAC Name: benzyl (2,5-dioxopyrrolidin-1-yl) carbonate SMILES: C1CC(=O)N(C1=O)OC(=O)OCC2=CC=CC=C2
| PubChem CID | 83172 |
|---|---|
| CAS | 13139-17-8 |
| Molecular Weight (g/mol) | 249.22 |
| MDL Number | MFCD00005513 |
| SMILES | C1CC(=O)N(C1=O)OC(=O)OCC2=CC=CC=C2 |
| Synonym | n-benzyloxycarbonyloxy succinimide,cbz-osu,cbz-onsu,benzyl 2,5-dioxopyrrolidin-1-yl carbonate,benzyl succinimido carbonate,z-osu,n-carbobenzoxyoxysuccinimide,n-benzyloxycarbonyloxy-succinimide,cbzosu,carbobenzoxy succinimide |
| IUPAC Name | benzyl (2,5-dioxopyrrolidin-1-yl) carbonate |
| InChI Key | MJSHDCCLFGOEIK-UHFFFAOYSA-N |
| Molecular Formula | C12H11NO5 |
1-Boc-piperidine-4-carboxaldehyde, 97%
CAS: 137076-22-3 Molecular Formula: C11H19NO3 Molecular Weight (g/mol): 213.28 MDL Number: MFCD02179019 InChI Key: JYUQEWCJWDGCRX-UHFFFAOYSA-N Synonym: 1-boc-4-piperidinecarboxaldehyde,1-boc-4-formylpiperidine,1-tert-butoxycarbonyl-4-piperidinecarboxaldehyde,1-boc-piperidine-4-carboxaldehyde,n-boc-4-formylpiperidine,n-boc-4-piperidinecarboxaldehyde,1-tert-butoxycarbonyl-4-formylpiperidine,4-formyl-piperidine-1-carboxylic acid tert-butyl ester,n-boc-piperidine-4-carbaldehyde,4-formylpiperidine-1-carboxylic acid tert-butyl ester PubChem CID: 1514430 IUPAC Name: tert-butyl 4-formylpiperidine-1-carboxylate SMILES: CC(C)(C)OC(=O)N1CCC(CC1)C=O
| PubChem CID | 1514430 |
|---|---|
| CAS | 137076-22-3 |
| Molecular Weight (g/mol) | 213.28 |
| MDL Number | MFCD02179019 |
| SMILES | CC(C)(C)OC(=O)N1CCC(CC1)C=O |
| Synonym | 1-boc-4-piperidinecarboxaldehyde,1-boc-4-formylpiperidine,1-tert-butoxycarbonyl-4-piperidinecarboxaldehyde,1-boc-piperidine-4-carboxaldehyde,n-boc-4-formylpiperidine,n-boc-4-piperidinecarboxaldehyde,1-tert-butoxycarbonyl-4-formylpiperidine,4-formyl-piperidine-1-carboxylic acid tert-butyl ester,n-boc-piperidine-4-carbaldehyde,4-formylpiperidine-1-carboxylic acid tert-butyl ester |
| IUPAC Name | tert-butyl 4-formylpiperidine-1-carboxylate |
| InChI Key | JYUQEWCJWDGCRX-UHFFFAOYSA-N |
| Molecular Formula | C11H19NO3 |
Imidazole, ≥99%, Molecular Biology Reagent, MP Biomedicals™
CAS: 288-32-4 Molecular Formula: C3H4N2 Molecular Weight (g/mol): 68.08 MDL Number: MFCD00005183 InChI Key: RAXXELZNTBOGNW-UHFFFAOYSA-N Synonym: imidazole,glyoxaline,imidazol,iminazole,miazole,1,3-diazole,glyoxalin,imutex,1,3-diaza-2,4-cyclopentadiene,pyrro b monazole PubChem CID: 795 ChEBI: CHEBI:16069 IUPAC Name: 1H-imidazole SMILES: N1C=CN=C1
| PubChem CID | 795 |
|---|---|
| CAS | 288-32-4 |
| Molecular Weight (g/mol) | 68.08 |
| ChEBI | CHEBI:16069 |
| MDL Number | MFCD00005183 |
| SMILES | N1C=CN=C1 |
| Synonym | imidazole,glyoxaline,imidazol,iminazole,miazole,1,3-diazole,glyoxalin,imutex,1,3-diaza-2,4-cyclopentadiene,pyrro b monazole |
| IUPAC Name | 1H-imidazole |
| InChI Key | RAXXELZNTBOGNW-UHFFFAOYSA-N |
| Molecular Formula | C3H4N2 |
2,7-Dimethylpyrazolo[1,5-a]pyrimidine-6-carboxylic acid, 97%
CAS: 175201-51-1 Molecular Formula: C9H9N3O2 Molecular Weight (g/mol): 191.19 MDL Number: MFCD00067901 InChI Key: CACYYYIWDACOAQ-UHFFFAOYSA-N Synonym: 2,7-dimethylpyrazolo 1,5-a pyrimidine-6-carboxylic acid,pyrazolo 1,5-a pyrimidine-6-carboxylic acid, 2,7-dimethyl,maybridge1_004672,6-carboxy-2,7-dimethylpyrazolo 1,5-a pyrimidine,pyrazolo 1,5-a pyrimidine-6-carboxylicacid, 2,7-dimethyl,2,7-dimethylpyrazolo 1,5-a pyrimidine-6-carboxylicacid,2,7-dimethyl-8-hydropyrazolo 1,5-a pyrimidine-6-carboxylic acid PubChem CID: 2736303 IUPAC Name: 2,7-dimethylpyrazolo[1,5-a]pyrimidine-6-carboxylic acid SMILES: CC1=NN2C(=C(C=NC2=C1)C(=O)O)C
| PubChem CID | 2736303 |
|---|---|
| CAS | 175201-51-1 |
| Molecular Weight (g/mol) | 191.19 |
| MDL Number | MFCD00067901 |
| SMILES | CC1=NN2C(=C(C=NC2=C1)C(=O)O)C |
| Synonym | 2,7-dimethylpyrazolo 1,5-a pyrimidine-6-carboxylic acid,pyrazolo 1,5-a pyrimidine-6-carboxylic acid, 2,7-dimethyl,maybridge1_004672,6-carboxy-2,7-dimethylpyrazolo 1,5-a pyrimidine,pyrazolo 1,5-a pyrimidine-6-carboxylicacid, 2,7-dimethyl,2,7-dimethylpyrazolo 1,5-a pyrimidine-6-carboxylicacid,2,7-dimethyl-8-hydropyrazolo 1,5-a pyrimidine-6-carboxylic acid |
| IUPAC Name | 2,7-dimethylpyrazolo[1,5-a]pyrimidine-6-carboxylic acid |
| InChI Key | CACYYYIWDACOAQ-UHFFFAOYSA-N |
| Molecular Formula | C9H9N3O2 |