Organoheterocyclic compounds
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[5-(2-Methyl-1,3-thiazol-4-yl)-3-isoxazolyl]methanol, 97%, Thermo Scientific™
CAS: 388088-79-7 Molecular Formula: C8H8N2O2S Molecular Weight (g/mol): 196.224 MDL Number: MFCD03086111 InChI Key: ANQHCDZMYKOBKX-UHFFFAOYSA-N Synonym: 5-2-methyl-1,3-thiazol-4-yl-3-isoxazolyl methanol,5-2-methyl-1,3-thiazol-4-yl-1,2-oxazol-3-yl methanol,5-2-methylthiazol-4-yl isoxazol-3-yl methanol,5-2-methyl-1,3-thiazol-4-yl isoxazol-3-yl methanol,5-2-methyl-1,3-thiazol-4-yl isoxazol-3-yl methan-1-ol PubChem CID: 2776410 IUPAC Name: [5-(2-methyl-1,3-thiazol-4-yl)-1,2-oxazol-3-yl]methanol SMILES: CC1=NC(=CS1)C2=CC(=NO2)CO
| PubChem CID | 2776410 |
|---|---|
| CAS | 388088-79-7 |
| Molecular Weight (g/mol) | 196.224 |
| MDL Number | MFCD03086111 |
| SMILES | CC1=NC(=CS1)C2=CC(=NO2)CO |
| Synonym | 5-2-methyl-1,3-thiazol-4-yl-3-isoxazolyl methanol,5-2-methyl-1,3-thiazol-4-yl-1,2-oxazol-3-yl methanol,5-2-methylthiazol-4-yl isoxazol-3-yl methanol,5-2-methyl-1,3-thiazol-4-yl isoxazol-3-yl methanol,5-2-methyl-1,3-thiazol-4-yl isoxazol-3-yl methan-1-ol |
| IUPAC Name | [5-(2-methyl-1,3-thiazol-4-yl)-1,2-oxazol-3-yl]methanol |
| InChI Key | ANQHCDZMYKOBKX-UHFFFAOYSA-N |
| Molecular Formula | C8H8N2O2S |
2-Amino-4-ethylpyridine, 97%
CAS: 33252-32-3 Molecular Formula: C7H11N2 Molecular Weight (g/mol): 123.18 MDL Number: MFCD00129025 InChI Key: SJWHILBZPGQBJE-UHFFFAOYSA-O Synonym: 2-amino-4-ethylpyridine,4-ethyl-pyridin-2-ylamine,4-ethyl-2-pyridinamine,2-pyridinamine, 4-ethyl,chembl62077,pubchem7108,4-ethyl-2-pyridylamine,4-ethyl-2-aminopyridine,acmc-20ao52 PubChem CID: 118425 IUPAC Name: 4-ethylpyridin-2-amine SMILES: CCC1=CC=[NH+]C(N)=C1
| PubChem CID | 118425 |
|---|---|
| CAS | 33252-32-3 |
| Molecular Weight (g/mol) | 123.18 |
| MDL Number | MFCD00129025 |
| SMILES | CCC1=CC=[NH+]C(N)=C1 |
| Synonym | 2-amino-4-ethylpyridine,4-ethyl-pyridin-2-ylamine,4-ethyl-2-pyridinamine,2-pyridinamine, 4-ethyl,chembl62077,pubchem7108,4-ethyl-2-pyridylamine,4-ethyl-2-aminopyridine,acmc-20ao52 |
| IUPAC Name | 4-ethylpyridin-2-amine |
| InChI Key | SJWHILBZPGQBJE-UHFFFAOYSA-O |
| Molecular Formula | C7H11N2 |
Trazodone hydrochloride, 98+%
CAS: 25332-39-2 Molecular Formula: C19H23Cl2N5O Molecular Weight (g/mol): 408.327 MDL Number: MFCD00079603 InChI Key: OHHDIOKRWWOXMT-UHFFFAOYSA-N Synonym: trazodone hydrochloride,trazodone hcl,desyrel,bimaran,molipaxin,devidon,pragmazone,thombran,tombran,tritico PubChem CID: 62935 ChEBI: CHEBI:9655 IUPAC Name: 2-[3-[4-(3-chlorophenyl)piperazin-1-yl]propyl]-[1,2,4]triazolo[4,3-a]pyridin-3-one;hydrochloride SMILES: C1CN(CCN1CCCN2C(=O)N3C=CC=CC3=N2)C4=CC(=CC=C4)Cl.Cl
| PubChem CID | 62935 |
|---|---|
| CAS | 25332-39-2 |
| Molecular Weight (g/mol) | 408.327 |
| ChEBI | CHEBI:9655 |
| MDL Number | MFCD00079603 |
| SMILES | C1CN(CCN1CCCN2C(=O)N3C=CC=CC3=N2)C4=CC(=CC=C4)Cl.Cl |
| Synonym | trazodone hydrochloride,trazodone hcl,desyrel,bimaran,molipaxin,devidon,pragmazone,thombran,tombran,tritico |
| IUPAC Name | 2-[3-[4-(3-chlorophenyl)piperazin-1-yl]propyl]-[1,2,4]triazolo[4,3-a]pyridin-3-one;hydrochloride |
| InChI Key | OHHDIOKRWWOXMT-UHFFFAOYSA-N |
| Molecular Formula | C19H23Cl2N5O |
5-Bromo-2-chloro-3-methylpyridine, 98%
CAS: 29241-60-9 Molecular Formula: C6H5BrClN Molecular Weight (g/mol): 206.467 MDL Number: MFCD03095093 InChI Key: YTSKHJMMNFPBBZ-UHFFFAOYSA-N Synonym: 2-chloro-3-methyl-5-bromopyridine,5-bromo-2-chloro-3-picoline,5-bromo-2-chloro-3-methyl pyridine,5-bromo-2-chloro-3-methyl-pyridine,pyridine, 5-bromo-2-chloro-3-methyl,2-chloro-5-bromo-3-picoline,2-chloro-3-methyl-5-bromo pyridine,pubchem1104,ksc495o9j PubChem CID: 285434 IUPAC Name: 5-bromo-2-chloro-3-methylpyridine SMILES: CC1=CC(=CN=C1Cl)Br
| PubChem CID | 285434 |
|---|---|
| CAS | 29241-60-9 |
| Molecular Weight (g/mol) | 206.467 |
| MDL Number | MFCD03095093 |
| SMILES | CC1=CC(=CN=C1Cl)Br |
| Synonym | 2-chloro-3-methyl-5-bromopyridine,5-bromo-2-chloro-3-picoline,5-bromo-2-chloro-3-methyl pyridine,5-bromo-2-chloro-3-methyl-pyridine,pyridine, 5-bromo-2-chloro-3-methyl,2-chloro-5-bromo-3-picoline,2-chloro-3-methyl-5-bromo pyridine,pubchem1104,ksc495o9j |
| IUPAC Name | 5-bromo-2-chloro-3-methylpyridine |
| InChI Key | YTSKHJMMNFPBBZ-UHFFFAOYSA-N |
| Molecular Formula | C6H5BrClN |
4-(2-Methyl-1H-imidazol-1-yl)benzonitrile, 97%, Thermo Scientific™
CAS: 122957-50-0 Molecular Formula: C11H9N3 Molecular Weight (g/mol): 183.21 MDL Number: MFCD08559033 InChI Key: FAMJRKMLLLJOGZ-UHFFFAOYSA-N PubChem CID: 15005384 IUPAC Name: 4-(2-methyl-1H-imidazol-1-yl)benzonitrile SMILES: CC1=NC=CN1C1=CC=C(C=C1)C#N
| PubChem CID | 15005384 |
|---|---|
| CAS | 122957-50-0 |
| Molecular Weight (g/mol) | 183.21 |
| MDL Number | MFCD08559033 |
| SMILES | CC1=NC=CN1C1=CC=C(C=C1)C#N |
| IUPAC Name | 4-(2-methyl-1H-imidazol-1-yl)benzonitrile |
| InChI Key | FAMJRKMLLLJOGZ-UHFFFAOYSA-N |
| Molecular Formula | C11H9N3 |
Dimethyl pyridine-2,5-dicarboxylate, 97%
CAS: 881-86-7 Molecular Formula: C9H9NO4 Molecular Weight (g/mol): 195.174 MDL Number: MFCD00034767 InChI Key: TUGSJNQAIMFEDY-UHFFFAOYSA-N Synonym: dimethyl 2,5-pyridinedicarboxylate,2,5-pyridinedicarboxylic acid, dimethyl ester,dimethylpyridine-2,5-dicarboxylate,2,5-dimethyl pyridine-2,5-dicarboxylate,dimethyl isocinchomeronate,pyridine-2,5-dicarboxylic acid dimethyl ester,dimethyl 2,5-pyridine dicarboxylate,acmc-1bkgx,maybridge1_006391,methyl 6-methoxycarbonylnicotinate PubChem CID: 234911 IUPAC Name: dimethyl pyridine-2,5-dicarboxylate SMILES: COC(=O)C1=CN=C(C=C1)C(=O)OC
| PubChem CID | 234911 |
|---|---|
| CAS | 881-86-7 |
| Molecular Weight (g/mol) | 195.174 |
| MDL Number | MFCD00034767 |
| SMILES | COC(=O)C1=CN=C(C=C1)C(=O)OC |
| Synonym | dimethyl 2,5-pyridinedicarboxylate,2,5-pyridinedicarboxylic acid, dimethyl ester,dimethylpyridine-2,5-dicarboxylate,2,5-dimethyl pyridine-2,5-dicarboxylate,dimethyl isocinchomeronate,pyridine-2,5-dicarboxylic acid dimethyl ester,dimethyl 2,5-pyridine dicarboxylate,acmc-1bkgx,maybridge1_006391,methyl 6-methoxycarbonylnicotinate |
| IUPAC Name | dimethyl pyridine-2,5-dicarboxylate |
| InChI Key | TUGSJNQAIMFEDY-UHFFFAOYSA-N |
| Molecular Formula | C9H9NO4 |
2,5-Lutidine, Spectrum™ Chemical
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CAS: 589-93-5
| CAS | 589-93-5 |
|---|
1-Methyl-1H-pyrazole, 97+%
CAS: 930-36-9 Molecular Formula: C4H6N2 Molecular Weight (g/mol): 82.106 MDL Number: MFCD00144943 InChI Key: UQFQONCQIQEYPJ-UHFFFAOYSA-N Synonym: 1-methyl-1h-pyrazole,n-methylpyrazole,1h-pyrazole, 1-methyl,pyrazole, 1-methyl,methylpyrazole,1-methyl pyrazole,1-methypyrazole,n-methyl pyrazole,1-methyl-pyrazole,zlchem 255 PubChem CID: 70255 ChEBI: CHEBI:59025 IUPAC Name: 1-methylpyrazole SMILES: CN1C=CC=N1
| PubChem CID | 70255 |
|---|---|
| CAS | 930-36-9 |
| Molecular Weight (g/mol) | 82.106 |
| ChEBI | CHEBI:59025 |
| MDL Number | MFCD00144943 |
| SMILES | CN1C=CC=N1 |
| Synonym | 1-methyl-1h-pyrazole,n-methylpyrazole,1h-pyrazole, 1-methyl,pyrazole, 1-methyl,methylpyrazole,1-methyl pyrazole,1-methypyrazole,n-methyl pyrazole,1-methyl-pyrazole,zlchem 255 |
| IUPAC Name | 1-methylpyrazole |
| InChI Key | UQFQONCQIQEYPJ-UHFFFAOYSA-N |
| Molecular Formula | C4H6N2 |
6-Quinolineboronic acid pinacol ester, 97%
CAS: 406463-06-7 Molecular Formula: C15H18BNO2 Molecular Weight (g/mol): 255.12 MDL Number: MFCD06411327 InChI Key: VMFALDWCEQUFSX-UHFFFAOYSA-N Synonym: 6-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl quinoline,6-quinolineboronic acid pinacol ester,quinoline-6-boronic acid pinacol ester,6-tetramethyl-1,3,2-dioxaborolan-2-yl quinoline,quinoline-6-boronic acid, pinacol ester,6-quinolylboronic acid pinacol ester,quinoline-5-boronic acid pinacol ester,2-quinolin-6-yl-4,4,5,5-tetramethyl-1,3,2-dioxaborolane,6-4,4,5,5-tetramethyl-1,3,2-dioxa-borolane-2-yl quinoline PubChem CID: 16217784 IUPAC Name: 6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)quinoline SMILES: CC1(C)OB(OC1(C)C)C1=CC2=CC=CN=C2C=C1
| PubChem CID | 16217784 |
|---|---|
| CAS | 406463-06-7 |
| Molecular Weight (g/mol) | 255.12 |
| MDL Number | MFCD06411327 |
| SMILES | CC1(C)OB(OC1(C)C)C1=CC2=CC=CN=C2C=C1 |
| Synonym | 6-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl quinoline,6-quinolineboronic acid pinacol ester,quinoline-6-boronic acid pinacol ester,6-tetramethyl-1,3,2-dioxaborolan-2-yl quinoline,quinoline-6-boronic acid, pinacol ester,6-quinolylboronic acid pinacol ester,quinoline-5-boronic acid pinacol ester,2-quinolin-6-yl-4,4,5,5-tetramethyl-1,3,2-dioxaborolane,6-4,4,5,5-tetramethyl-1,3,2-dioxa-borolane-2-yl quinoline |
| IUPAC Name | 6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)quinoline |
| InChI Key | VMFALDWCEQUFSX-UHFFFAOYSA-N |
| Molecular Formula | C15H18BNO2 |
2,3-Dibromo-5-(trifluoromethyl)pyridine, 95%, Thermo Scientific Chemicals
CAS: 79623-38-4 Molecular Formula: C6H2Br2F3N Molecular Weight (g/mol): 304.89 MDL Number: MFCD10687233 InChI Key: BIDFUURRDIAINQ-UHFFFAOYSA-N PubChem CID: 26985667 IUPAC Name: 2,3-dibromo-5-(trifluoromethyl)pyridine SMILES: FC(F)(F)C1=CC(Br)=C(Br)N=C1
| PubChem CID | 26985667 |
|---|---|
| CAS | 79623-38-4 |
| Molecular Weight (g/mol) | 304.89 |
| MDL Number | MFCD10687233 |
| SMILES | FC(F)(F)C1=CC(Br)=C(Br)N=C1 |
| IUPAC Name | 2,3-dibromo-5-(trifluoromethyl)pyridine |
| InChI Key | BIDFUURRDIAINQ-UHFFFAOYSA-N |
| Molecular Formula | C6H2Br2F3N |
2-Methyl-2-oxazoline, 99%
CAS: 1120-64-5 Molecular Formula: C4H7NO Molecular Weight (g/mol): 85.11 MDL Number: MFCD00005298 InChI Key: GUXJXWKCUUWCLX-UHFFFAOYSA-N Synonym: 2-methyl-2-oxazoline,2-methyloxazoline,2-methyl-4,5-dihydrooxazole,oxazole, 4,5-dihydro-2-methyl,2-methyl-2-oxazolin,2-methyl-1,3-oxazoline,2-oxazoline, 2-methyl,4,5-dihydro-2-methyl-1,3-oxazole,poly 2-methyl-2-oxazoline,methyl oxazoline PubChem CID: 70713 ChEBI: CHEBI:53614 IUPAC Name: 2-methyl-4,5-dihydro-1,3-oxazole SMILES: CC1=NCCO1
| PubChem CID | 70713 |
|---|---|
| CAS | 1120-64-5 |
| Molecular Weight (g/mol) | 85.11 |
| ChEBI | CHEBI:53614 |
| MDL Number | MFCD00005298 |
| SMILES | CC1=NCCO1 |
| Synonym | 2-methyl-2-oxazoline,2-methyloxazoline,2-methyl-4,5-dihydrooxazole,oxazole, 4,5-dihydro-2-methyl,2-methyl-2-oxazolin,2-methyl-1,3-oxazoline,2-oxazoline, 2-methyl,4,5-dihydro-2-methyl-1,3-oxazole,poly 2-methyl-2-oxazoline,methyl oxazoline |
| IUPAC Name | 2-methyl-4,5-dihydro-1,3-oxazole |
| InChI Key | GUXJXWKCUUWCLX-UHFFFAOYSA-N |
| Molecular Formula | C4H7NO |
N-Ethylmaleimide, 98+%
CAS: 128-53-0 Molecular Formula: C6H7NO2 Molecular Weight (g/mol): 125.127 MDL Number: MFCD00005509 InChI Key: HDFGOPSGAURCEO-UHFFFAOYSA-N Synonym: n-ethylmaleimide,ethylmaleimide,1-ethyl-1h-pyrrole-2,5-dione,maleimide, n-ethyl,1h-pyrrole-2,5-dione, 1-ethyl,maleic acid n-ethylimide,nem,usaf b-121,unii-o3c74acm9v,maleic acid-n-ethylimide PubChem CID: 4362 ChEBI: CHEBI:44485 IUPAC Name: 1-ethylpyrrole-2,5-dione SMILES: CCN1C(=O)C=CC1=O
| PubChem CID | 4362 |
|---|---|
| CAS | 128-53-0 |
| Molecular Weight (g/mol) | 125.127 |
| ChEBI | CHEBI:44485 |
| MDL Number | MFCD00005509 |
| SMILES | CCN1C(=O)C=CC1=O |
| Synonym | n-ethylmaleimide,ethylmaleimide,1-ethyl-1h-pyrrole-2,5-dione,maleimide, n-ethyl,1h-pyrrole-2,5-dione, 1-ethyl,maleic acid n-ethylimide,nem,usaf b-121,unii-o3c74acm9v,maleic acid-n-ethylimide |
| IUPAC Name | 1-ethylpyrrole-2,5-dione |
| InChI Key | HDFGOPSGAURCEO-UHFFFAOYSA-N |
| Molecular Formula | C6H7NO2 |
3-Phthalimidopropionic acid, 98%
CAS: 3339-73-9 Molecular Formula: C11H9NO4 Molecular Weight (g/mol): 219.196 MDL Number: MFCD00023096 InChI Key: DXXHRZUOTPMGEH-UHFFFAOYSA-N Synonym: 3-phthalimidopropionic acid,3-1,3-dioxoisoindolin-2-yl propanoic acid,2h-isoindole-2-propanoic acid, 1,3-dihydro-1,3-dioxo,3-1,3-dioxo-1,3-dihydro-2h-isoindol-2-yl propanoic acid,3-1,3-dioxo-2,3-dihydro-1h-isoindol-2-yl propanoic acid,pht-beta-ala-oh,b-phthalimidopropionic acid,3-phthalimidopropanoic acid,n-phthaloyl-beta-alanine,phthalyl-.beta.-alanine PubChem CID: 76859 IUPAC Name: 3-(1,3-dioxoisoindol-2-yl)propanoic acid SMILES: C1=CC=C2C(=C1)C(=O)N(C2=O)CCC(=O)O
| PubChem CID | 76859 |
|---|---|
| CAS | 3339-73-9 |
| Molecular Weight (g/mol) | 219.196 |
| MDL Number | MFCD00023096 |
| SMILES | C1=CC=C2C(=C1)C(=O)N(C2=O)CCC(=O)O |
| Synonym | 3-phthalimidopropionic acid,3-1,3-dioxoisoindolin-2-yl propanoic acid,2h-isoindole-2-propanoic acid, 1,3-dihydro-1,3-dioxo,3-1,3-dioxo-1,3-dihydro-2h-isoindol-2-yl propanoic acid,3-1,3-dioxo-2,3-dihydro-1h-isoindol-2-yl propanoic acid,pht-beta-ala-oh,b-phthalimidopropionic acid,3-phthalimidopropanoic acid,n-phthaloyl-beta-alanine,phthalyl-.beta.-alanine |
| IUPAC Name | 3-(1,3-dioxoisoindol-2-yl)propanoic acid |
| InChI Key | DXXHRZUOTPMGEH-UHFFFAOYSA-N |
| Molecular Formula | C11H9NO4 |
2-Bromopyridine-3-carboxylic acid, 97%, Thermo Scientific™
CAS: 35905-85-2 Molecular Formula: C6H4BrNO2 Molecular Weight (g/mol): 202.01 MDL Number: MFCD01646068 InChI Key: MMWNKXIFVYQOTK-UHFFFAOYSA-N Synonym: 2-bromonicotinic acid,2-bromo-3-pyridinecarboxylic acid,3-pyridinecarboxylic acid, 2-bromo,2-bromo-nicotinic acid,2-bromo-3-carboxypyridine,3-bromopyridine-3-carboxylic acid,bromo-nicotinic acid,pubchem5071,acmc-1aj4p,ksc223s8f PubChem CID: 233262 IUPAC Name: 2-bromopyridine-3-carboxylic acid SMILES: C1=CC(=C(N=C1)Br)C(=O)O
| PubChem CID | 233262 |
|---|---|
| CAS | 35905-85-2 |
| Molecular Weight (g/mol) | 202.01 |
| MDL Number | MFCD01646068 |
| SMILES | C1=CC(=C(N=C1)Br)C(=O)O |
| Synonym | 2-bromonicotinic acid,2-bromo-3-pyridinecarboxylic acid,3-pyridinecarboxylic acid, 2-bromo,2-bromo-nicotinic acid,2-bromo-3-carboxypyridine,3-bromopyridine-3-carboxylic acid,bromo-nicotinic acid,pubchem5071,acmc-1aj4p,ksc223s8f |
| IUPAC Name | 2-bromopyridine-3-carboxylic acid |
| InChI Key | MMWNKXIFVYQOTK-UHFFFAOYSA-N |
| Molecular Formula | C6H4BrNO2 |
2,8-Bis(trifluoromethyl)-4-quinolinol, 99%, Thermo Scientific™
CAS: 35853-41-9 Molecular Formula: C11H5F6NO Molecular Weight (g/mol): 281.15 MDL Number: MFCD00075091 InChI Key: JIWHKBAFGFPZKM-UHFFFAOYSA-N Synonym: 2,8-bis trifluoromethyl-4-hydroxyquinoline,2,8-bis trifluoromethyl quinolin-4-ol,2,8-bis trifluoromethyl-4-quinolinol,2,8-bis trifluoromethyl-1h-quinolin-4-one,2,8-bis-trifluoromethyl-quinolin-4-ol,cc-pmlsc-dma-p104,4-quinolinol, 2,8-bis trifluoromethyl,2,8-bis trifluoromethyl-4-hydroxy quinoleine,2,8-di trifluoromethyl quinolin-4-ol,pubchem5934 PubChem CID: 736140 IUPAC Name: 2,8-bis(trifluoromethyl)-1H-quinolin-4-one SMILES: C1=CC2=C(C(=C1)C(F)(F)F)NC(=CC2=O)C(F)(F)F
| PubChem CID | 736140 |
|---|---|
| CAS | 35853-41-9 |
| Molecular Weight (g/mol) | 281.15 |
| MDL Number | MFCD00075091 |
| SMILES | C1=CC2=C(C(=C1)C(F)(F)F)NC(=CC2=O)C(F)(F)F |
| Synonym | 2,8-bis trifluoromethyl-4-hydroxyquinoline,2,8-bis trifluoromethyl quinolin-4-ol,2,8-bis trifluoromethyl-4-quinolinol,2,8-bis trifluoromethyl-1h-quinolin-4-one,2,8-bis-trifluoromethyl-quinolin-4-ol,cc-pmlsc-dma-p104,4-quinolinol, 2,8-bis trifluoromethyl,2,8-bis trifluoromethyl-4-hydroxy quinoleine,2,8-di trifluoromethyl quinolin-4-ol,pubchem5934 |
| IUPAC Name | 2,8-bis(trifluoromethyl)-1H-quinolin-4-one |
| InChI Key | JIWHKBAFGFPZKM-UHFFFAOYSA-N |
| Molecular Formula | C11H5F6NO |