Organoheterocyclic compounds
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Ethyl 8-chloro-6-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxylate, 95%
CAS: 353258-31-8 Molecular Formula: C11H8ClF3N2O2 Molecular Weight (g/mol): 292.642 MDL Number: MFCD01833013 InChI Key: AKACORAIGDTIFR-UHFFFAOYSA-N Synonym: ethyl 8-chloro-6-trifluoromethyl imidazo 1,2-a pyridine-2-carboxylate,8-chloro-6-trifluoromethyl-imidazo 1,2-a pyridine-2-carboxylic acid ethyl ester,ethyl 8-chloro-6-trifluoromethyl imidazo 1,2-a-pyridine-2-carboxylate,4,6-dimethylbenzofuran-3-carboxylic acid,ethyl 8-chloro-6-trifluoromethyl-imidazo 1,2-a pyridine-2-carboxylate,8-chloro-6-trifluoromethyl imidazo 1,2,a pyridine-2-carboxylic acid ethyl ester,8-chloro-6-trifluoromethyl-imidazo1,2-apyridine-2-carboxylic acid ethyl ester PubChem CID: 737427 IUPAC Name: ethyl 8-chloro-6-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxylate SMILES: CCOC(=O)C1=CN2C=C(C=C(C2=N1)Cl)C(F)(F)F
| PubChem CID | 737427 |
|---|---|
| CAS | 353258-31-8 |
| Molecular Weight (g/mol) | 292.642 |
| MDL Number | MFCD01833013 |
| SMILES | CCOC(=O)C1=CN2C=C(C=C(C2=N1)Cl)C(F)(F)F |
| Synonym | ethyl 8-chloro-6-trifluoromethyl imidazo 1,2-a pyridine-2-carboxylate,8-chloro-6-trifluoromethyl-imidazo 1,2-a pyridine-2-carboxylic acid ethyl ester,ethyl 8-chloro-6-trifluoromethyl imidazo 1,2-a-pyridine-2-carboxylate,4,6-dimethylbenzofuran-3-carboxylic acid,ethyl 8-chloro-6-trifluoromethyl-imidazo 1,2-a pyridine-2-carboxylate,8-chloro-6-trifluoromethyl imidazo 1,2,a pyridine-2-carboxylic acid ethyl ester,8-chloro-6-trifluoromethyl-imidazo1,2-apyridine-2-carboxylic acid ethyl ester |
| IUPAC Name | ethyl 8-chloro-6-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxylate |
| InChI Key | AKACORAIGDTIFR-UHFFFAOYSA-N |
| Molecular Formula | C11H8ClF3N2O2 |
2-Phenylthiophene, 95%
CAS: 825-55-8 Molecular Formula: C10H8S Molecular Weight (g/mol): 160.234 MDL Number: MFCD00130080 InChI Key: PJRGDKFLFAYRBV-UHFFFAOYSA-N Synonym: thiophene, 2-phenyl,2-phenyl-thiophene,phenylthiophene,thiophene, phenyl,2-thienylbenzene,2-phenyithiophene,2-phenylthiofuran,2-phenylthiophene,acmc-209ppe PubChem CID: 69999 IUPAC Name: 2-phenylthiophene SMILES: C1=CC=C(C=C1)C2=CC=CS2
| PubChem CID | 69999 |
|---|---|
| CAS | 825-55-8 |
| Molecular Weight (g/mol) | 160.234 |
| MDL Number | MFCD00130080 |
| SMILES | C1=CC=C(C=C1)C2=CC=CS2 |
| Synonym | thiophene, 2-phenyl,2-phenyl-thiophene,phenylthiophene,thiophene, phenyl,2-thienylbenzene,2-phenyithiophene,2-phenylthiofuran,2-phenylthiophene,acmc-209ppe |
| IUPAC Name | 2-phenylthiophene |
| InChI Key | PJRGDKFLFAYRBV-UHFFFAOYSA-N |
| Molecular Formula | C10H8S |
4-Thiouridine, 98+%
CAS: 13957-31-8 Molecular Formula: C9H12N2O5S Molecular Weight (g/mol): 260.26 MDL Number: MFCD00006538 InChI Key: ZLOIGESWDJYCTF-XVFCMESISA-N PubChem CID: 3032615 ChEBI: CHEBI:20480 SMILES: OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)N1C=CC(=S)NC1=O
| PubChem CID | 3032615 |
|---|---|
| CAS | 13957-31-8 |
| Molecular Weight (g/mol) | 260.26 |
| ChEBI | CHEBI:20480 |
| MDL Number | MFCD00006538 |
| SMILES | OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)N1C=CC(=S)NC1=O |
| InChI Key | ZLOIGESWDJYCTF-XVFCMESISA-N |
| Molecular Formula | C9H12N2O5S |
1-Methyl-1H-benzimidazole-5-carboxylic acid, 97%, Thermo Scientific™
CAS: 53484-17-6 Molecular Formula: C9H8N2O2 Molecular Weight (g/mol): 176.175 MDL Number: MFCD06809665 InChI Key: KAJLCBKTWRUQOI-UHFFFAOYSA-N Synonym: 1-methyl-1h-benzimidazole-5-carboxylic acid,1-methyl-1h-benzo d imidazole-5-carboxylic acid,1h-benzimidazole-5-carboxylic acid, 1-methyl,1-methyl-1h-1,3-benzodiazole-5-carboxylic acid,1-methyl-1,3-benzodiazole-5-carboxylic acid,1h-benzimidazole-5-carboxylicacid, 1-methyl,1-methyl-5-benzimidazolecarboxylic acid,1-methyl-1h-benzimidazole-5-carboxylicacid,1-methylbenzimidazol-5-carboxylic acid,1-methylbenzimidazole-5-carboxylicacid PubChem CID: 4913063 IUPAC Name: 1-methylbenzimidazole-5-carboxylic acid SMILES: CN1C=NC2=C1C=CC(=C2)C(=O)O
| PubChem CID | 4913063 |
|---|---|
| CAS | 53484-17-6 |
| Molecular Weight (g/mol) | 176.175 |
| MDL Number | MFCD06809665 |
| SMILES | CN1C=NC2=C1C=CC(=C2)C(=O)O |
| Synonym | 1-methyl-1h-benzimidazole-5-carboxylic acid,1-methyl-1h-benzo d imidazole-5-carboxylic acid,1h-benzimidazole-5-carboxylic acid, 1-methyl,1-methyl-1h-1,3-benzodiazole-5-carboxylic acid,1-methyl-1,3-benzodiazole-5-carboxylic acid,1h-benzimidazole-5-carboxylicacid, 1-methyl,1-methyl-5-benzimidazolecarboxylic acid,1-methyl-1h-benzimidazole-5-carboxylicacid,1-methylbenzimidazol-5-carboxylic acid,1-methylbenzimidazole-5-carboxylicacid |
| IUPAC Name | 1-methylbenzimidazole-5-carboxylic acid |
| InChI Key | KAJLCBKTWRUQOI-UHFFFAOYSA-N |
| Molecular Formula | C9H8N2O2 |
2,5-Diiodo-1-methylimidazole, 98%, Thermo Scientific Chemicals
CAS: 86026-81-5 Molecular Formula: C4H4I2N2 Molecular Weight (g/mol): 333.899 MDL Number: MFCD02179540 InChI Key: SZYKHAFVWJNSQU-UHFFFAOYSA-N PubChem CID: 335838 IUPAC Name: 2,5-diiodo-1-methylimidazole SMILES: CN1C(=CN=C1I)I
| PubChem CID | 335838 |
|---|---|
| CAS | 86026-81-5 |
| Molecular Weight (g/mol) | 333.899 |
| MDL Number | MFCD02179540 |
| SMILES | CN1C(=CN=C1I)I |
| IUPAC Name | 2,5-diiodo-1-methylimidazole |
| InChI Key | SZYKHAFVWJNSQU-UHFFFAOYSA-N |
| Molecular Formula | C4H4I2N2 |
delta-Valerolactam, 98%
CAS: 675-20-7 Molecular Formula: C5H9NO Molecular Weight (g/mol): 99.13 MDL Number: MFCD00006037 InChI Key: XUWHAWMETYGRKB-UHFFFAOYSA-N Synonym: 2-piperidone,2-piperidinone,delta-valerolactam,valerolactim,5-pentanolactam,piperidinone,piperidon,piperidone,alpha-piperidone,piperidone-2 PubChem CID: 12665 ChEBI: CHEBI:77761 IUPAC Name: piperidin-2-one SMILES: O=C1CCCCN1
| PubChem CID | 12665 |
|---|---|
| CAS | 675-20-7 |
| Molecular Weight (g/mol) | 99.13 |
| ChEBI | CHEBI:77761 |
| MDL Number | MFCD00006037 |
| SMILES | O=C1CCCCN1 |
| Synonym | 2-piperidone,2-piperidinone,delta-valerolactam,valerolactim,5-pentanolactam,piperidinone,piperidon,piperidone,alpha-piperidone,piperidone-2 |
| IUPAC Name | piperidin-2-one |
| InChI Key | XUWHAWMETYGRKB-UHFFFAOYSA-N |
| Molecular Formula | C5H9NO |
1-Methyl-3-n-octylimidazolium tetrafluoroborate, 99%
CAS: 244193-52-0 Molecular Formula: C12H23BF4N2 Molecular Weight (g/mol): 282.13 MDL Number: MFCD03095434 InChI Key: GXZCAMSPWNHTAE-UHFFFAOYSA-N Synonym: 1-methyl-3-octylimidazolium tetrafluoroborate,1-methyl-3-n-octylimidazolium tetrafluoroborate,3-methyl-1-octylimidazolium tetrafluoroborate,1-octyl-3-methylimidazolium tetrafluoroborate,omimbf4,dsstox_cid_27919,dsstox_rid_82672,dsstox_gsid_47943,3-methyl-1-octylimidazoliumtetrafluoroborate,1-methyl-3-octylimidazolium tetrafluoroborate hplc PubChem CID: 11460221 SMILES: F[B-](F)(F)F.CCCCCCCCN1C=C[N+](C)=C1
| PubChem CID | 11460221 |
|---|---|
| CAS | 244193-52-0 |
| Molecular Weight (g/mol) | 282.13 |
| MDL Number | MFCD03095434 |
| SMILES | F[B-](F)(F)F.CCCCCCCCN1C=C[N+](C)=C1 |
| Synonym | 1-methyl-3-octylimidazolium tetrafluoroborate,1-methyl-3-n-octylimidazolium tetrafluoroborate,3-methyl-1-octylimidazolium tetrafluoroborate,1-octyl-3-methylimidazolium tetrafluoroborate,omimbf4,dsstox_cid_27919,dsstox_rid_82672,dsstox_gsid_47943,3-methyl-1-octylimidazoliumtetrafluoroborate,1-methyl-3-octylimidazolium tetrafluoroborate hplc |
| InChI Key | GXZCAMSPWNHTAE-UHFFFAOYSA-N |
| Molecular Formula | C12H23BF4N2 |
5-Bromo-2-(4-morpholinyl)benzonitrile, 98%
CAS: 1105665-08-4 Molecular Formula: C11H11BrN2O Molecular Weight (g/mol): 267.126 InChI Key: IENSJQPUDLLAOI-UHFFFAOYSA-N Synonym: 5-bromo-2-morpholino benzonitrile,5-bromo-2-morpholinobenzonitrile,5-bromo-2-morpholin-4-yl benzonitrile PubChem CID: 59558545 IUPAC Name: 5-bromo-2-morpholin-4-ylbenzonitrile SMILES: C1COCCN1C2=C(C=C(C=C2)Br)C#N
| PubChem CID | 59558545 |
|---|---|
| CAS | 1105665-08-4 |
| Molecular Weight (g/mol) | 267.126 |
| SMILES | C1COCCN1C2=C(C=C(C=C2)Br)C#N |
| Synonym | 5-bromo-2-morpholino benzonitrile,5-bromo-2-morpholinobenzonitrile,5-bromo-2-morpholin-4-yl benzonitrile |
| IUPAC Name | 5-bromo-2-morpholin-4-ylbenzonitrile |
| InChI Key | IENSJQPUDLLAOI-UHFFFAOYSA-N |
| Molecular Formula | C11H11BrN2O |
3-Bromo-2-nitropyridine, 98+%
CAS: 54231-33-3 Molecular Formula: C5H3BrN2O2 Molecular Weight (g/mol): 203.00 MDL Number: MFCD00955614 InChI Key: WFNISJZUJCKTLT-UHFFFAOYSA-N Synonym: 2-nitro-3-bromopyridine,pyridine, 3-bromo-2-nitro,3-bromo-2-nitro-pyridine,pubchem4502,pubchem10100,acmc-1ay9l,#,ksc494a7n,3-bromo-2-nitriopyridine PubChem CID: 594044 IUPAC Name: 3-bromo-2-nitropyridine SMILES: [O-][N+](=O)C1=NC=CC=C1Br
| PubChem CID | 594044 |
|---|---|
| CAS | 54231-33-3 |
| Molecular Weight (g/mol) | 203.00 |
| MDL Number | MFCD00955614 |
| SMILES | [O-][N+](=O)C1=NC=CC=C1Br |
| Synonym | 2-nitro-3-bromopyridine,pyridine, 3-bromo-2-nitro,3-bromo-2-nitro-pyridine,pubchem4502,pubchem10100,acmc-1ay9l,#,ksc494a7n,3-bromo-2-nitriopyridine |
| IUPAC Name | 3-bromo-2-nitropyridine |
| InChI Key | WFNISJZUJCKTLT-UHFFFAOYSA-N |
| Molecular Formula | C5H3BrN2O2 |
3-Amino-1-(4-chlorophenyl)-1H-pyrazole, 95%, Thermo Scientific™
CAS: 66000-39-3 Molecular Formula: C9H8ClN3 Molecular Weight (g/mol): 193.634 MDL Number: MFCD09027932 InChI Key: SHCVEWFQFUKSDP-UHFFFAOYSA-N Synonym: 1-4-chlorophenyl-1h-pyrazol-3-amine,3-amino-1-4-chlorophenyl-1h-pyrazole,1-4-chlorophenyl pyrazol-3-amine,1-p-chlorophenyl-3-amino-pyrazole,1-4-chlorophenyl-1h-pyrazol-3-ylamine,1-4-chloro-phenyl-1h-pyrazol-3-ylamine PubChem CID: 13626945 IUPAC Name: 1-(4-chlorophenyl)pyrazol-3-amine SMILES: C1=CC(=CC=C1N2C=CC(=N2)N)Cl
| PubChem CID | 13626945 |
|---|---|
| CAS | 66000-39-3 |
| Molecular Weight (g/mol) | 193.634 |
| MDL Number | MFCD09027932 |
| SMILES | C1=CC(=CC=C1N2C=CC(=N2)N)Cl |
| Synonym | 1-4-chlorophenyl-1h-pyrazol-3-amine,3-amino-1-4-chlorophenyl-1h-pyrazole,1-4-chlorophenyl pyrazol-3-amine,1-p-chlorophenyl-3-amino-pyrazole,1-4-chlorophenyl-1h-pyrazol-3-ylamine,1-4-chloro-phenyl-1h-pyrazol-3-ylamine |
| IUPAC Name | 1-(4-chlorophenyl)pyrazol-3-amine |
| InChI Key | SHCVEWFQFUKSDP-UHFFFAOYSA-N |
| Molecular Formula | C9H8ClN3 |
2-n-Propylthiazole, 99%
CAS: 17626-75-4 Molecular Formula: C6H9NS Molecular Weight (g/mol): 127.205 MDL Number: MFCD00053154 InChI Key: CMOIEFFAOUQJPS-UHFFFAOYSA-N PubChem CID: 87198 IUPAC Name: 2-propyl-1,3-thiazole SMILES: CCCC1=NC=CS1
| PubChem CID | 87198 |
|---|---|
| CAS | 17626-75-4 |
| Molecular Weight (g/mol) | 127.205 |
| MDL Number | MFCD00053154 |
| SMILES | CCCC1=NC=CS1 |
| IUPAC Name | 2-propyl-1,3-thiazole |
| InChI Key | CMOIEFFAOUQJPS-UHFFFAOYSA-N |
| Molecular Formula | C6H9NS |
Methyl 3-methyl-2-furoate, 98%
CAS: 6141-57-7 Molecular Formula: C7H8O3 Molecular Weight (g/mol): 140.14 MDL Number: MFCD00014110 InChI Key: AQQYRDKMXXSIMP-UHFFFAOYSA-N Synonym: methyl 3-methyl-2-furoate,methyl 3-methylfuroate,methyl 3-methyl-2-furancarboxylate,furancarboxylic acid, methyl-, methyl ester,3-methyl-2-furancarboxylic acid methyl ester,3-methyl-furan-2-carboxylic acid methyl ester,2-furoic acid, 3-methyl-, methyl ester,acmc-20a9f6,methyl-3-methyl-2-furoate,2-furancarboxylic acid, 3-methyl-, methyl ester PubChem CID: 350231 IUPAC Name: methyl 3-methylfuran-2-carboxylate SMILES: COC(=O)C1=C(C)C=CO1
| PubChem CID | 350231 |
|---|---|
| CAS | 6141-57-7 |
| Molecular Weight (g/mol) | 140.14 |
| MDL Number | MFCD00014110 |
| SMILES | COC(=O)C1=C(C)C=CO1 |
| Synonym | methyl 3-methyl-2-furoate,methyl 3-methylfuroate,methyl 3-methyl-2-furancarboxylate,furancarboxylic acid, methyl-, methyl ester,3-methyl-2-furancarboxylic acid methyl ester,3-methyl-furan-2-carboxylic acid methyl ester,2-furoic acid, 3-methyl-, methyl ester,acmc-20a9f6,methyl-3-methyl-2-furoate,2-furancarboxylic acid, 3-methyl-, methyl ester |
| IUPAC Name | methyl 3-methylfuran-2-carboxylate |
| InChI Key | AQQYRDKMXXSIMP-UHFFFAOYSA-N |
| Molecular Formula | C7H8O3 |
Ethyl 5-(chloromethyl)-2-furancarboxylate, 95%
CAS: 2528-00-9 Molecular Formula: C8H9ClO3 Molecular Weight (g/mol): 188.61 MDL Number: MFCD00173837 InChI Key: JBACYJRMCXLIQU-UHFFFAOYSA-N Synonym: ethyl 5-chloromethyl-2-furoate,ethyl 5-chloromethyl furan-2-carboxylate,ethyl 5-chloromethyl-2-furancarboxylate,5-chloromethyl-2-furancarboxylic acid ethyl ester,2-furancarboxylic acid, 5-chloromethyl-, ethyl ester,buttpark 9650-29,acmc-1cej4,ethyl 2-chloromethyl-5-furoate PubChem CID: 263166 IUPAC Name: ethyl 5-(chloromethyl)furan-2-carboxylate SMILES: CCOC(=O)C1=CC=C(O1)CCl
| PubChem CID | 263166 |
|---|---|
| CAS | 2528-00-9 |
| Molecular Weight (g/mol) | 188.61 |
| MDL Number | MFCD00173837 |
| SMILES | CCOC(=O)C1=CC=C(O1)CCl |
| Synonym | ethyl 5-chloromethyl-2-furoate,ethyl 5-chloromethyl furan-2-carboxylate,ethyl 5-chloromethyl-2-furancarboxylate,5-chloromethyl-2-furancarboxylic acid ethyl ester,2-furancarboxylic acid, 5-chloromethyl-, ethyl ester,buttpark 9650-29,acmc-1cej4,ethyl 2-chloromethyl-5-furoate |
| IUPAC Name | ethyl 5-(chloromethyl)furan-2-carboxylate |
| InChI Key | JBACYJRMCXLIQU-UHFFFAOYSA-N |
| Molecular Formula | C8H9ClO3 |
Methyl 5-bromo-2-furoate, 97%
CAS: 2527-99-3 Molecular Formula: C6H5BrO3 MDL Number: MFCD00092313 InChI Key: FBPIDMAELBIRLE-UHFFFAOYSA-N Synonym: methyl 5-bromo-2-furoate,methyl 5-bromo-2-furancarboxylate,5-bromo-2-furoic acid methyl ester,2-furancarboxylic acid, 5-bromo-, methyl ester,5-bromo-2-furancarboxylic acid methyl ester,5-bromofuran-2-carboxylic acid methyl ester,methyl 5-bromofuroate,2-furoic acid, 5-bromo-, methyl ester,methyl 5-bromo-furanate,maybridge1_004996 PubChem CID: 599633 IUPAC Name: methyl 5-bromofuran-2-carboxylate
| PubChem CID | 599633 |
|---|---|
| CAS | 2527-99-3 |
| MDL Number | MFCD00092313 |
| Synonym | methyl 5-bromo-2-furoate,methyl 5-bromo-2-furancarboxylate,5-bromo-2-furoic acid methyl ester,2-furancarboxylic acid, 5-bromo-, methyl ester,5-bromo-2-furancarboxylic acid methyl ester,5-bromofuran-2-carboxylic acid methyl ester,methyl 5-bromofuroate,2-furoic acid, 5-bromo-, methyl ester,methyl 5-bromo-furanate,maybridge1_004996 |
| IUPAC Name | methyl 5-bromofuran-2-carboxylate |
| InChI Key | FBPIDMAELBIRLE-UHFFFAOYSA-N |
| Molecular Formula | C6H5BrO3 |