Organoheterocyclic compounds
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5-Bromopicolinic acid, 97%
CAS: 30766-11-1 Molecular Formula: C6H3BrNO2 Molecular Weight (g/mol): 201.00 MDL Number: MFCD00234149 InChI Key: MNNQIBXLAHVDDL-UHFFFAOYSA-M Synonym: 5-bromopicolinic acid,5-bromo-2-pyridinecarboxylic acid,2-pyridinecarboxylic acid, 5-bromo,5-bromo-2-carboxypyridine,5-bromo-pyridine-2-carboxylic acid,5-bromo-2-picolinic acid,5-bromo-2-carboxy pyridine,5-bromo-2-pyridine carboxylic acid,5-bromopyridine-2-carboxylicacid PubChem CID: 608544 SMILES: [O-]C(=O)C1=CC=C(Br)C=N1
| PubChem CID | 608544 |
|---|---|
| CAS | 30766-11-1 |
| Molecular Weight (g/mol) | 201.00 |
| MDL Number | MFCD00234149 |
| SMILES | [O-]C(=O)C1=CC=C(Br)C=N1 |
| Synonym | 5-bromopicolinic acid,5-bromo-2-pyridinecarboxylic acid,2-pyridinecarboxylic acid, 5-bromo,5-bromo-2-carboxypyridine,5-bromo-pyridine-2-carboxylic acid,5-bromo-2-picolinic acid,5-bromo-2-carboxy pyridine,5-bromo-2-pyridine carboxylic acid,5-bromopyridine-2-carboxylicacid |
| InChI Key | MNNQIBXLAHVDDL-UHFFFAOYSA-M |
| Molecular Formula | C6H3BrNO2 |
Brucine, 99%, anhydrous
CAS: 357-57-3 Molecular Formula: C23H26N2O4 Molecular Weight (g/mol): 394.46 MDL Number: MFCD00005942 InChI Key: RRKTZKIUPZVBMF-VLTSECPOSA-N Synonym: brucine, anhydrous,brucine:strychnidin-10-one,2,3-dimethoxy PubChem CID: 51413923 IUPAC Name: (4aR,5aS,8aR,13aS,15aR,15bS)-10,11-dimethoxy-4a,5,5a,7,8,13a,15,15a,15b,16-decahydro-2H-4,6-methanoindolo[3,2,1-ij]oxepino[2,3,4-de]pyrrolo[2,3-h]quinoline-14-one SMILES: COC1=C(C=C2C(=C1)C34CCN5C3CC6C7C4N2C(=O)CC7OCC=C6C5)OC
| PubChem CID | 51413923 |
|---|---|
| CAS | 357-57-3 |
| Molecular Weight (g/mol) | 394.46 |
| MDL Number | MFCD00005942 |
| SMILES | COC1=C(C=C2C(=C1)C34CCN5C3CC6C7C4N2C(=O)CC7OCC=C6C5)OC |
| Synonym | brucine, anhydrous,brucine:strychnidin-10-one,2,3-dimethoxy |
| IUPAC Name | (4aR,5aS,8aR,13aS,15aR,15bS)-10,11-dimethoxy-4a,5,5a,7,8,13a,15,15a,15b,16-decahydro-2H-4,6-methanoindolo[3,2,1-ij]oxepino[2,3,4-de]pyrrolo[2,3-h]quinoline-14-one |
| InChI Key | RRKTZKIUPZVBMF-VLTSECPOSA-N |
| Molecular Formula | C23H26N2O4 |
4-Hydroxypyridine, 95%
CAS: 626-64-2 Molecular Formula: C5H5NO Molecular Weight (g/mol): 95.10 MDL Number: MFCD00006419,MFCD00040458 InChI Key: GCNTZFIIOFTKIY-UHFFFAOYSA-N Synonym: 4-hydroxypyridine,pyridin-4-ol,4-pyridinol,4-pyridone,4 1h-pyridinone,pyridin-4 1h-one,4-oxopyridine,4-pyridinone,4-pyridol,gamma-hydroxypyridine PubChem CID: 12290 IUPAC Name: 1H-pyridin-4-one SMILES: O=C1C=CNC=C1
| PubChem CID | 12290 |
|---|---|
| CAS | 626-64-2 |
| Molecular Weight (g/mol) | 95.10 |
| MDL Number | MFCD00006419,MFCD00040458 |
| SMILES | O=C1C=CNC=C1 |
| Synonym | 4-hydroxypyridine,pyridin-4-ol,4-pyridinol,4-pyridone,4 1h-pyridinone,pyridin-4 1h-one,4-oxopyridine,4-pyridinone,4-pyridol,gamma-hydroxypyridine |
| IUPAC Name | 1H-pyridin-4-one |
| InChI Key | GCNTZFIIOFTKIY-UHFFFAOYSA-N |
| Molecular Formula | C5H5NO |
cis-Dichlorobis(2,2'-bipyridine)ruthenium(II) dihydrate, 99%
CAS: 15746-57-3 Molecular Formula: C20H16Cl2N4Ru·2H2O Molecular Weight (g/mol): 520.38 MDL Number: MFCD00015504 InChI Key: NHKTUSUPCAKVHT-UHFFFAOYSA-L Synonym: cis-dichlorobis 2,2'-bipyridine ruthenium ii dihydrate, 99,cis-dichlorobis 2,2'-bipyridine-ruthenium ii dihydrate PubChem CID: 71463877 IUPAC Name: 2-pyridin-2-ylpyridine;ruthenium(2+);dichloride;dihydrate SMILES: C1=CC=NC(=C1)C2=CC=CC=N2.C1=CC=NC(=C1)C2=CC=CC=N2.O.O.[Cl-].[Cl-].[Ru+2]
| PubChem CID | 71463877 |
|---|---|
| CAS | 15746-57-3 |
| Molecular Weight (g/mol) | 520.38 |
| MDL Number | MFCD00015504 |
| SMILES | C1=CC=NC(=C1)C2=CC=CC=N2.C1=CC=NC(=C1)C2=CC=CC=N2.O.O.[Cl-].[Cl-].[Ru+2] |
| Synonym | cis-dichlorobis 2,2'-bipyridine ruthenium ii dihydrate, 99,cis-dichlorobis 2,2'-bipyridine-ruthenium ii dihydrate |
| IUPAC Name | 2-pyridin-2-ylpyridine;ruthenium(2+);dichloride;dihydrate |
| InChI Key | NHKTUSUPCAKVHT-UHFFFAOYSA-L |
| Molecular Formula | C20H16Cl2N4Ru·2H2O |
5-Bromo-2-chloro-3-nitropyridine, 98%
CAS: 67443-38-3 Molecular Formula: C5H2BrClN2O2 Molecular Weight (g/mol): 237.44 MDL Number: MFCD00222270 InChI Key: WWQQPSDIIVXFOX-UHFFFAOYSA-N Synonym: 2-chloro-3-nitro-5-bromopyridine,5-bromo-2-chloro-3-nitro-pyridine,pyridine, 5-bromo-2-chloro-3-nitro,abbypharma ap-12-5159,zlchem 393,pubchem1166,acmc-209nz1,ksc352q2l,5-bromo-2-chloro-3-nitropyridin,2-chloro-5-bromo-3-nitropyridine PubChem CID: 7019412 IUPAC Name: 5-bromo-2-chloro-3-nitropyridine SMILES: [O-][N+](=O)C1=CC(Br)=CN=C1Cl
| PubChem CID | 7019412 |
|---|---|
| CAS | 67443-38-3 |
| Molecular Weight (g/mol) | 237.44 |
| MDL Number | MFCD00222270 |
| SMILES | [O-][N+](=O)C1=CC(Br)=CN=C1Cl |
| Synonym | 2-chloro-3-nitro-5-bromopyridine,5-bromo-2-chloro-3-nitro-pyridine,pyridine, 5-bromo-2-chloro-3-nitro,abbypharma ap-12-5159,zlchem 393,pubchem1166,acmc-209nz1,ksc352q2l,5-bromo-2-chloro-3-nitropyridin,2-chloro-5-bromo-3-nitropyridine |
| IUPAC Name | 5-bromo-2-chloro-3-nitropyridine |
| InChI Key | WWQQPSDIIVXFOX-UHFFFAOYSA-N |
| Molecular Formula | C5H2BrClN2O2 |
2-chloro-5-(trifluoromethyl)pyridine, 98+%
CAS: 52334-81-3 Molecular Formula: C6H3ClF3N Molecular Weight (g/mol): 181.54 MDL Number: MFCD00042225 InChI Key: JFZJMSDDOOAOIV-UHFFFAOYSA-N Synonym: 2-chloro-5-trifluoromethyl pyridine,2,5-ctf,pyridine, 2-chloro-5-trifluoromethyl,ccris 6430,5-trifluoromethyl-2-chloropyridine,unii-c9g66d966b,2-chloro-5-trifluoropyridine,2-chloro-5 trifluoromethyl pyridine PubChem CID: 92342 IUPAC Name: 2-chloro-5-(trifluoromethyl)pyridine SMILES: FC(F)(F)C1=CC=C(Cl)N=C1
| PubChem CID | 92342 |
|---|---|
| CAS | 52334-81-3 |
| Molecular Weight (g/mol) | 181.54 |
| MDL Number | MFCD00042225 |
| SMILES | FC(F)(F)C1=CC=C(Cl)N=C1 |
| Synonym | 2-chloro-5-trifluoromethyl pyridine,2,5-ctf,pyridine, 2-chloro-5-trifluoromethyl,ccris 6430,5-trifluoromethyl-2-chloropyridine,unii-c9g66d966b,2-chloro-5-trifluoropyridine,2-chloro-5 trifluoromethyl pyridine |
| IUPAC Name | 2-chloro-5-(trifluoromethyl)pyridine |
| InChI Key | JFZJMSDDOOAOIV-UHFFFAOYSA-N |
| Molecular Formula | C6H3ClF3N |
1-Chloroisoquinoline, 97+%
CAS: 19493-44-8 Molecular Formula: C9H6ClN Molecular Weight (g/mol): 163.61 MDL Number: MFCD00024134 InChI Key: MSQCQINLJMEVNJ-UHFFFAOYSA-N Synonym: 1-chloro-isoquinoline,isoquinoline, 1-chloro,chloroisoquinoline,isoquinoline, chloro,1-chloroisoquinone,1-chloro isoquinoline,zlchem 1129,pubchem13906,acmc-1bowu,1-chloroisoquinoline PubChem CID: 140539 IUPAC Name: 1-chloroisoquinoline SMILES: C1=CC=C2C(=C1)C=CN=C2Cl
| PubChem CID | 140539 |
|---|---|
| CAS | 19493-44-8 |
| Molecular Weight (g/mol) | 163.61 |
| MDL Number | MFCD00024134 |
| SMILES | C1=CC=C2C(=C1)C=CN=C2Cl |
| Synonym | 1-chloro-isoquinoline,isoquinoline, 1-chloro,chloroisoquinoline,isoquinoline, chloro,1-chloroisoquinone,1-chloro isoquinoline,zlchem 1129,pubchem13906,acmc-1bowu,1-chloroisoquinoline |
| IUPAC Name | 1-chloroisoquinoline |
| InChI Key | MSQCQINLJMEVNJ-UHFFFAOYSA-N |
| Molecular Formula | C9H6ClN |
2-Chloro-4-iodopyridine, 98%
CAS: 153034-86-7 Molecular Formula: C5H3ClIN Molecular Weight (g/mol): 239.44 MDL Number: MFCD01861983 InChI Key: KJKIPRQNFDUULB-UHFFFAOYSA-N Synonym: 2-chloro-4-iodo-pyridine,4-iodo-2-chloropyridine,2-chloro-iodopyridine,pyridine, 2-chloro-4-iodo,zlchem 826,pubchem2579,acmc-209d8n,2-chloro-4-iodo pyridine,ksc174s0f,2-chloro-4-iodopyridine PubChem CID: 1516511 IUPAC Name: 2-chloro-4-iodopyridine SMILES: C1=CN=C(C=C1I)Cl
| PubChem CID | 1516511 |
|---|---|
| CAS | 153034-86-7 |
| Molecular Weight (g/mol) | 239.44 |
| MDL Number | MFCD01861983 |
| SMILES | C1=CN=C(C=C1I)Cl |
| Synonym | 2-chloro-4-iodo-pyridine,4-iodo-2-chloropyridine,2-chloro-iodopyridine,pyridine, 2-chloro-4-iodo,zlchem 826,pubchem2579,acmc-209d8n,2-chloro-4-iodo pyridine,ksc174s0f,2-chloro-4-iodopyridine |
| IUPAC Name | 2-chloro-4-iodopyridine |
| InChI Key | KJKIPRQNFDUULB-UHFFFAOYSA-N |
| Molecular Formula | C5H3ClIN |
2,6-Dichloropyridine-N-oxide, 98%
CAS: 2587-00-0 Molecular Formula: C5H3Cl2NO Molecular Weight (g/mol): 163.99 MDL Number: MFCD00130246 InChI Key: RFOMGVDPYLWLOC-UHFFFAOYSA-N Synonym: 2,6-dichloropyridine n-oxide,2,6-dichloropyridine 1-oxide,2,6-dichloropyridine-n-oxide,2,6-dichloropyridin-1-ium-1-olate,pyridine, 2,6-dichloro-, 1-oxide,2,6-dichloropyridine-1-oxide,2,6-dichloropyridine n-o,ide,acmc-1cjmr,2,6-dichloropyridin-1-ol PubChem CID: 817673 IUPAC Name: 2,6-dichloro-1-oxidopyridin-1-ium SMILES: [O-][N+]1=C(Cl)C=CC=C1Cl
| PubChem CID | 817673 |
|---|---|
| CAS | 2587-00-0 |
| Molecular Weight (g/mol) | 163.99 |
| MDL Number | MFCD00130246 |
| SMILES | [O-][N+]1=C(Cl)C=CC=C1Cl |
| Synonym | 2,6-dichloropyridine n-oxide,2,6-dichloropyridine 1-oxide,2,6-dichloropyridine-n-oxide,2,6-dichloropyridin-1-ium-1-olate,pyridine, 2,6-dichloro-, 1-oxide,2,6-dichloropyridine-1-oxide,2,6-dichloropyridine n-o,ide,acmc-1cjmr,2,6-dichloropyridin-1-ol |
| IUPAC Name | 2,6-dichloro-1-oxidopyridin-1-ium |
| InChI Key | RFOMGVDPYLWLOC-UHFFFAOYSA-N |
| Molecular Formula | C5H3Cl2NO |
3,4-Dihydro-2(1H)-quinolinone, 98%
CAS: 553-03-7 Molecular Formula: C9H9NO Molecular Weight (g/mol): 147.18 MDL Number: MFCD00016722 InChI Key: TZOYXRMEFDYWDQ-UHFFFAOYSA-N Synonym: 3,4-dihydro-2 1h-quinolinone,3,4-dihydroquinolin-2 1h-one,hydrocarbostyril,1,2,3,4-tetrahydroquinolin-2-one,3,4-dihydrocarbostyril,2-oxo-1,2,3,4-tetrahydroquinoline,dihydro-quinolinone,3,4-dihydro-2-quinolinol,o-aminohydrocinnamic acid lactam,unii-2ckg6tx32f PubChem CID: 64796 IUPAC Name: 3,4-dihydro-1H-quinolin-2-one SMILES: O=C1CCC2=CC=CC=C2N1
| PubChem CID | 64796 |
|---|---|
| CAS | 553-03-7 |
| Molecular Weight (g/mol) | 147.18 |
| MDL Number | MFCD00016722 |
| SMILES | O=C1CCC2=CC=CC=C2N1 |
| Synonym | 3,4-dihydro-2 1h-quinolinone,3,4-dihydroquinolin-2 1h-one,hydrocarbostyril,1,2,3,4-tetrahydroquinolin-2-one,3,4-dihydrocarbostyril,2-oxo-1,2,3,4-tetrahydroquinoline,dihydro-quinolinone,3,4-dihydro-2-quinolinol,o-aminohydrocinnamic acid lactam,unii-2ckg6tx32f |
| IUPAC Name | 3,4-dihydro-1H-quinolin-2-one |
| InChI Key | TZOYXRMEFDYWDQ-UHFFFAOYSA-N |
| Molecular Formula | C9H9NO |
3,4-Methylenedioxyacetophenone, 98%
CAS: 3162-29-6 Molecular Formula: C9H8O3 Molecular Weight (g/mol): 164.16 MDL Number: MFCD00005831 InChI Key: BMHMKWXYXFBWMI-UHFFFAOYSA-N Synonym: 3',4'-methylenedioxy acetophenone,1-benzo d 1,3 dioxol-5-yl ethanone,5-acetyl-1,3-benzodioxole,3,4-methylenedioxyacetophenone,3,4-methylenedioxy acetophenone,3',4'-methylenedioxyacetophenone,1-1,3-benzodioxol-5-yl ethanone,acetopiperone,1-1,3-benzodioxol-5-yl ethan-1-one,ethanone, 1-1,3-benzodioxol-5-yl PubChem CID: 76622 IUPAC Name: 1-(1,3-benzodioxol-5-yl)ethanone SMILES: CC(=O)C1=CC2=C(C=C1)OCO2
| PubChem CID | 76622 |
|---|---|
| CAS | 3162-29-6 |
| Molecular Weight (g/mol) | 164.16 |
| MDL Number | MFCD00005831 |
| SMILES | CC(=O)C1=CC2=C(C=C1)OCO2 |
| Synonym | 3',4'-methylenedioxy acetophenone,1-benzo d 1,3 dioxol-5-yl ethanone,5-acetyl-1,3-benzodioxole,3,4-methylenedioxyacetophenone,3,4-methylenedioxy acetophenone,3',4'-methylenedioxyacetophenone,1-1,3-benzodioxol-5-yl ethanone,acetopiperone,1-1,3-benzodioxol-5-yl ethan-1-one,ethanone, 1-1,3-benzodioxol-5-yl |
| IUPAC Name | 1-(1,3-benzodioxol-5-yl)ethanone |
| InChI Key | BMHMKWXYXFBWMI-UHFFFAOYSA-N |
| Molecular Formula | C9H8O3 |
6-Bromo-2-picoline, 97%
CAS: 5315-25-3 Molecular Formula: C6H6BrN Molecular Weight (g/mol): 172.03 MDL Number: MFCD00040743 InChI Key: SOHDPICLICFSOP-UHFFFAOYSA-N Synonym: 2-bromo-6-picoline,6-bromo-2-picoline,6-bromo-2-methylpyridine,2-bromo-6-methyl-pyridine,2-bromo-6-methyl pyridine,2-brom-6-methylpyridin,pyridine, 2-bromo-6-methyl,2-bromo-6-methy pyridine,6-bromopicoline,6-methyl-2-bromopyridine PubChem CID: 79205 IUPAC Name: 2-bromo-6-methylpyridine SMILES: CC1=CC=CC(Br)=N1
| PubChem CID | 79205 |
|---|---|
| CAS | 5315-25-3 |
| Molecular Weight (g/mol) | 172.03 |
| MDL Number | MFCD00040743 |
| SMILES | CC1=CC=CC(Br)=N1 |
| Synonym | 2-bromo-6-picoline,6-bromo-2-picoline,6-bromo-2-methylpyridine,2-bromo-6-methyl-pyridine,2-bromo-6-methyl pyridine,2-brom-6-methylpyridin,pyridine, 2-bromo-6-methyl,2-bromo-6-methy pyridine,6-bromopicoline,6-methyl-2-bromopyridine |
| IUPAC Name | 2-bromo-6-methylpyridine |
| InChI Key | SOHDPICLICFSOP-UHFFFAOYSA-N |
| Molecular Formula | C6H6BrN |
3-Hydroxyquinoline, 97+%
CAS: 580-18-7 Molecular Formula: C9H7NO Molecular Weight (g/mol): 145.16 MDL Number: MFCD00169018 InChI Key: IQQDNMHUOLMLNJ-UHFFFAOYSA-N Synonym: 3-hydroxyquinoline,3-quinolinol,3-quinolol,ccris 4328,unii-12pz582ci0,quinolin-3-o1,3-hydroxy-quinoline,pubchem12770,5-21-03-00224 beilstein handbook reference,ksc270k2r PubChem CID: 11376 IUPAC Name: quinolin-3-ol SMILES: C1=CC=C2C(=C1)C=C(C=N2)O
| PubChem CID | 11376 |
|---|---|
| CAS | 580-18-7 |
| Molecular Weight (g/mol) | 145.16 |
| MDL Number | MFCD00169018 |
| SMILES | C1=CC=C2C(=C1)C=C(C=N2)O |
| Synonym | 3-hydroxyquinoline,3-quinolinol,3-quinolol,ccris 4328,unii-12pz582ci0,quinolin-3-o1,3-hydroxy-quinoline,pubchem12770,5-21-03-00224 beilstein handbook reference,ksc270k2r |
| IUPAC Name | quinolin-3-ol |
| InChI Key | IQQDNMHUOLMLNJ-UHFFFAOYSA-N |
| Molecular Formula | C9H7NO |
2,3-Dichloro-5-(trifluoromethyl)pyridine, 97%
CAS: 69045-84-7 Molecular Formula: C6H2Cl2F3N Molecular Weight (g/mol): 215.98 MDL Number: MFCD00042243 InChI Key: ABNQGNFVSFKJGI-UHFFFAOYSA-N Synonym: 2,3-dichloro-5-trifluoromethyl pyridine,unii-5f2c8lx8ie,2,3-dichloro-5-trifluoro methylpyridine,2,3,5-dctf,5f2c8lx8ie,2,3-dichloro-5-trifluoromethyl-pyridine,pyridine, 2,3-dichloro-5-trifluoromethyl,pubchem9237 PubChem CID: 112234 IUPAC Name: 2,3-dichloro-5-(trifluoromethyl)pyridine SMILES: FC(F)(F)C1=CN=C(Cl)C(Cl)=C1
| PubChem CID | 112234 |
|---|---|
| CAS | 69045-84-7 |
| Molecular Weight (g/mol) | 215.98 |
| MDL Number | MFCD00042243 |
| SMILES | FC(F)(F)C1=CN=C(Cl)C(Cl)=C1 |
| Synonym | 2,3-dichloro-5-trifluoromethyl pyridine,unii-5f2c8lx8ie,2,3-dichloro-5-trifluoro methylpyridine,2,3,5-dctf,5f2c8lx8ie,2,3-dichloro-5-trifluoromethyl-pyridine,pyridine, 2,3-dichloro-5-trifluoromethyl,pubchem9237 |
| IUPAC Name | 2,3-dichloro-5-(trifluoromethyl)pyridine |
| InChI Key | ABNQGNFVSFKJGI-UHFFFAOYSA-N |
| Molecular Formula | C6H2Cl2F3N |
2-Thiophenecarboxamide, 99%, Thermo Scientific™
CAS: 5813-89-8 Molecular Formula: C5H5NOS Molecular Weight (g/mol): 127.17 MDL Number: MFCD00010425 InChI Key: DENPQNAWGQXKCU-UHFFFAOYSA-N Synonym: 2-thiophenecarboxamide,2-thienylamide,2-thenamide,thiophen-2-carboxamide,2-aminocarbonyl thiophene,2-thienylamide french,thiophenecarboxamide,thiolamide,acmc-1ao1m,5-18-06-00162 beilstein handbook reference PubChem CID: 22063 IUPAC Name: thiophene-2-carboxamide SMILES: C1=CSC(=C1)C(=O)N
| PubChem CID | 22063 |
|---|---|
| CAS | 5813-89-8 |
| Molecular Weight (g/mol) | 127.17 |
| MDL Number | MFCD00010425 |
| SMILES | C1=CSC(=C1)C(=O)N |
| Synonym | 2-thiophenecarboxamide,2-thienylamide,2-thenamide,thiophen-2-carboxamide,2-aminocarbonyl thiophene,2-thienylamide french,thiophenecarboxamide,thiolamide,acmc-1ao1m,5-18-06-00162 beilstein handbook reference |
| IUPAC Name | thiophene-2-carboxamide |
| InChI Key | DENPQNAWGQXKCU-UHFFFAOYSA-N |
| Molecular Formula | C5H5NOS |