Organoheterocyclic compounds
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1-Cyclohexene-1,2-dicarboxylic Anhydride 98.0+%, TCI America™
CAS: 2426-02-0 Molecular Formula: C8H8O3 Molecular Weight (g/mol): 152.15 MDL Number: MFCD00005917 InChI Key: HMMBJOWWRLZEMI-UHFFFAOYSA-N Synonym: 3,4,5,6-tetrahydrophthalic anhydride,4,5,6,7-tetrahydroisobenzofuran-1,3-dione,1-cyclohexene-1,2-dicarboxylic anhydride,1,3-isobenzofurandione, 4,5,6,7-tetrahydro,unii-01d3m89a2w,cyclohexene-1,2-dicarboxylic anhydride,3,4,5,6-tetrahydrophthalic acid anhydride,1,3,4,5,6,7-hexahydro-2-benzofuran-1,3-dione,1, 4,5,6,7-tetrahydro,4,5,6,7-tetrahydro-1,3-isobenzofurandione PubChem CID: 12475 IUPAC Name: 1,3,4,5,6,7-hexahydro-2-benzofuran-1,3-dione SMILES: O=C1OC(=O)C2=C1CCCC2
| PubChem CID | 12475 |
|---|---|
| CAS | 2426-02-0 |
| Molecular Weight (g/mol) | 152.15 |
| MDL Number | MFCD00005917 |
| SMILES | O=C1OC(=O)C2=C1CCCC2 |
| Synonym | 3,4,5,6-tetrahydrophthalic anhydride,4,5,6,7-tetrahydroisobenzofuran-1,3-dione,1-cyclohexene-1,2-dicarboxylic anhydride,1,3-isobenzofurandione, 4,5,6,7-tetrahydro,unii-01d3m89a2w,cyclohexene-1,2-dicarboxylic anhydride,3,4,5,6-tetrahydrophthalic acid anhydride,1,3,4,5,6,7-hexahydro-2-benzofuran-1,3-dione,1, 4,5,6,7-tetrahydro,4,5,6,7-tetrahydro-1,3-isobenzofurandione |
| IUPAC Name | 1,3,4,5,6,7-hexahydro-2-benzofuran-1,3-dione |
| InChI Key | HMMBJOWWRLZEMI-UHFFFAOYSA-N |
| Molecular Formula | C8H8O3 |
2-Cyano-3-methylpyridine 98.0+%, TCI America™
CAS: 20970-75-6 Molecular Formula: C7H6N2 Molecular Weight (g/mol): 118.139 MDL Number: MFCD00190585 InChI Key: WBXZCDIZXWDPBL-UHFFFAOYSA-N Synonym: 2-cyano-3-methylpyridine,3-methylpicolinonitrile,2-cyano-3-methyl pyridine,3-methyl-2-pyridinecarbonitrile,pyridinecarbonitrile, methyl,3-methyl-pyridine-2-carbonitrile,2-cyano-3-methyl-pyridine,2-pyridinecarbonitrile, 3-methyl,2-cyano-3-methylpyridine 2-cyano-3-picoline,2-cyano-3-picoline PubChem CID: 819928 IUPAC Name: 3-methylpyridine-2-carbonitrile SMILES: CC1=C(N=CC=C1)C#N
| PubChem CID | 819928 |
|---|---|
| CAS | 20970-75-6 |
| Molecular Weight (g/mol) | 118.139 |
| MDL Number | MFCD00190585 |
| SMILES | CC1=C(N=CC=C1)C#N |
| Synonym | 2-cyano-3-methylpyridine,3-methylpicolinonitrile,2-cyano-3-methyl pyridine,3-methyl-2-pyridinecarbonitrile,pyridinecarbonitrile, methyl,3-methyl-pyridine-2-carbonitrile,2-cyano-3-methyl-pyridine,2-pyridinecarbonitrile, 3-methyl,2-cyano-3-methylpyridine 2-cyano-3-picoline,2-cyano-3-picoline |
| IUPAC Name | 3-methylpyridine-2-carbonitrile |
| InChI Key | WBXZCDIZXWDPBL-UHFFFAOYSA-N |
| Molecular Formula | C7H6N2 |
2-Chloro-3-(chloromethyl)quinoline 98.0+%, TCI America™
CAS: 90097-52-2 Molecular Formula: C10H7Cl2N Molecular Weight (g/mol): 212.073 MDL Number: MFCD05865134 InChI Key: UOIJHUIOTFDGNA-UHFFFAOYSA-N Synonym: 2-chloro-3-chloromethyl quinoline,quinoline, 2-chloro-3-chloromethyl,2-chloranyl-3-chloromethyl quinoline PubChem CID: 2063384 IUPAC Name: 2-chloro-3-(chloromethyl)quinoline SMILES: C1=CC=C2C(=C1)C=C(C(=N2)Cl)CCl
| PubChem CID | 2063384 |
|---|---|
| CAS | 90097-52-2 |
| Molecular Weight (g/mol) | 212.073 |
| MDL Number | MFCD05865134 |
| SMILES | C1=CC=C2C(=C1)C=C(C(=N2)Cl)CCl |
| Synonym | 2-chloro-3-chloromethyl quinoline,quinoline, 2-chloro-3-chloromethyl,2-chloranyl-3-chloromethyl quinoline |
| IUPAC Name | 2-chloro-3-(chloromethyl)quinoline |
| InChI Key | UOIJHUIOTFDGNA-UHFFFAOYSA-N |
| Molecular Formula | C10H7Cl2N |
10-Methoxy-5H-dibenzo[b,f]azepine 98.0+%, TCI America™
CAS: 11-7-4698 Molecular Formula: C15H13NO Molecular Weight (g/mol): 223.28 MDL Number: MFCD00101079 InChI Key: ZKHZWXLOSIGIGZ-UHFFFAOYSA-N Synonym: 10-Methoxy-2,2′C-iminostilbene PubChem CID: 78424 IUPAC Name: 5-methoxy-11H-benzo[b][1]benzazepine SMILES: COC1=CC2=CC=CC=C2NC3=CC=CC=C31
| PubChem CID | 78424 |
|---|---|
| CAS | 11-7-4698 |
| Molecular Weight (g/mol) | 223.28 |
| MDL Number | MFCD00101079 |
| SMILES | COC1=CC2=CC=CC=C2NC3=CC=CC=C31 |
| Synonym | 10-Methoxy-2,2′C-iminostilbene |
| IUPAC Name | 5-methoxy-11H-benzo[b][1]benzazepine |
| InChI Key | ZKHZWXLOSIGIGZ-UHFFFAOYSA-N |
| Molecular Formula | C15H13NO |
1-Methyl-1-propylpyrrolidinium Bis(trifluoromethanesulfonyl)imide 98.0+%, TCI America™
CAS: 223437-05-6 Molecular Formula: C10H18F6N2O4S2 Molecular Weight (g/mol): 408.374 MDL Number: MFCD08458917 InChI Key: DKNRELLLVOYIIB-UHFFFAOYSA-N PubChem CID: 25171607 IUPAC Name: bis(trifluoromethylsulfonyl)azanide;1-methyl-1-propylpyrrolidin-1-ium SMILES: CCC[N+]1(CCCC1)C.C(F)(F)(F)S(=O)(=O)[N-]S(=O)(=O)C(F)(F)F
| PubChem CID | 25171607 |
|---|---|
| CAS | 223437-05-6 |
| Molecular Weight (g/mol) | 408.374 |
| MDL Number | MFCD08458917 |
| SMILES | CCC[N+]1(CCCC1)C.C(F)(F)(F)S(=O)(=O)[N-]S(=O)(=O)C(F)(F)F |
| IUPAC Name | bis(trifluoromethylsulfonyl)azanide;1-methyl-1-propylpyrrolidin-1-ium |
| InChI Key | DKNRELLLVOYIIB-UHFFFAOYSA-N |
| Molecular Formula | C10H18F6N2O4S2 |
Harmine Hydrochloride 98.0+%, TCI America™
CAS: 343-27-1 Molecular Formula: C13H13ClN2O Molecular Weight (g/mol): 248.71 MDL Number: MFCD00012641 InChI Key: VNPLYCKZIUTKJM-UHFFFAOYSA-N Synonym: Banisterine Hydrochloride PubChem CID: 5359389 IUPAC Name: hydrogen 7-methoxy-1-methyl-9H-pyrido[3,4-b]indole chloride SMILES: [H+].[Cl-].COC1=CC2=C(C=C1)C1=C(N2)C(C)=NC=C1
| PubChem CID | 5359389 |
|---|---|
| CAS | 343-27-1 |
| Molecular Weight (g/mol) | 248.71 |
| MDL Number | MFCD00012641 |
| SMILES | [H+].[Cl-].COC1=CC2=C(C=C1)C1=C(N2)C(C)=NC=C1 |
| Synonym | Banisterine Hydrochloride |
| IUPAC Name | hydrogen 7-methoxy-1-methyl-9H-pyrido[3,4-b]indole chloride |
| InChI Key | VNPLYCKZIUTKJM-UHFFFAOYSA-N |
| Molecular Formula | C13H13ClN2O |
2-Heptadecylimidazole 85.0+%, TCI America™
CAS: 23328-87-2 Molecular Formula: C20H38N2 Molecular Weight (g/mol): 306.538 MDL Number: MFCD00038620 InChI Key: YTWBFUCJVWKCCK-UHFFFAOYSA-N PubChem CID: 90068 IUPAC Name: 2-heptadecyl-1H-imidazole SMILES: CCCCCCCCCCCCCCCCCC1=NC=CN1
| PubChem CID | 90068 |
|---|---|
| CAS | 23328-87-2 |
| Molecular Weight (g/mol) | 306.538 |
| MDL Number | MFCD00038620 |
| SMILES | CCCCCCCCCCCCCCCCCC1=NC=CN1 |
| IUPAC Name | 2-heptadecyl-1H-imidazole |
| InChI Key | YTWBFUCJVWKCCK-UHFFFAOYSA-N |
| Molecular Formula | C20H38N2 |
6'-Methoxy-2,3'-bipyridyl 97.0+%, TCI America™
CAS: 381725-49-1 Molecular Formula: C11H10N2O Molecular Weight (g/mol): 186.214 MDL Number: MFCD11707142 InChI Key: HRVJUCXZUHFRNP-UHFFFAOYSA-N Synonym: 6′C-Methoxy-2,3′C-bipyridine PubChem CID: 10899365 IUPAC Name: 2-methoxy-5-pyridin-2-ylpyridine SMILES: COC1=NC=C(C=C1)C2=CC=CC=N2
| PubChem CID | 10899365 |
|---|---|
| CAS | 381725-49-1 |
| Molecular Weight (g/mol) | 186.214 |
| MDL Number | MFCD11707142 |
| SMILES | COC1=NC=C(C=C1)C2=CC=CC=N2 |
| Synonym | 6′C-Methoxy-2,3′C-bipyridine |
| IUPAC Name | 2-methoxy-5-pyridin-2-ylpyridine |
| InChI Key | HRVJUCXZUHFRNP-UHFFFAOYSA-N |
| Molecular Formula | C11H10N2O |
Methyl 6-Bromopyridine-2-carboxylate 98.0+%, TCI America™
CAS: 26218-75-7 Molecular Formula: C7H6BrNO2 Molecular Weight (g/mol): 216.03 MDL Number: MFCD06203934 InChI Key: SGNCOKUHMXLGAH-UHFFFAOYSA-N Synonym: methyl 6-bromopicolinate,6-bromopyridine-2-carboxylic acid methyl ester,6-bromopicolinic acid methyl ester,methyl 6-bromo-2-pyridinecarboxylate,6-bromo-2-pyridine carboxylic acid methyl ester,2-pyridinecarboxylic acid, 6-bromo-, methyl ester,2-bromo-6-methoxycarbonyl pyridine,methyl 2-bromo-6-nicotinate,methyl-6-bromopyridine-2-carboxylate,methyl-6-bromo-2-pyridine carboxylate PubChem CID: 16217886 IUPAC Name: methyl 6-bromopyridine-2-carboxylate SMILES: COC(=O)C1=NC(Br)=CC=C1
| PubChem CID | 16217886 |
|---|---|
| CAS | 26218-75-7 |
| Molecular Weight (g/mol) | 216.03 |
| MDL Number | MFCD06203934 |
| SMILES | COC(=O)C1=NC(Br)=CC=C1 |
| Synonym | methyl 6-bromopicolinate,6-bromopyridine-2-carboxylic acid methyl ester,6-bromopicolinic acid methyl ester,methyl 6-bromo-2-pyridinecarboxylate,6-bromo-2-pyridine carboxylic acid methyl ester,2-pyridinecarboxylic acid, 6-bromo-, methyl ester,2-bromo-6-methoxycarbonyl pyridine,methyl 2-bromo-6-nicotinate,methyl-6-bromopyridine-2-carboxylate,methyl-6-bromo-2-pyridine carboxylate |
| IUPAC Name | methyl 6-bromopyridine-2-carboxylate |
| InChI Key | SGNCOKUHMXLGAH-UHFFFAOYSA-N |
| Molecular Formula | C7H6BrNO2 |
Methyl 3-Methyl-2-furancarboxylate 98.0+%, TCI America™
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 |
Methyl 4-Aminonicotinate 98.0+%, TCI America™
CAS: 16135-36-7 Molecular Formula: C7H8N2O2 Molecular Weight (g/mol): 152.15 MDL Number: MFCD00955996 InChI Key: OCARFFAPQGYGBP-UHFFFAOYSA-N Synonym: methyl 4-aminonicotinate,4-aminonicotinic acid methyl ester,4-amino-nicotinic acid methyl ester,4-aminopyridine-3-carboxylic acid methyl ester,3-pyridinecarboxylic acid, 4-amino-, methyl ester,nicotinic acid, 4-amino-, methyl ester,4-aminonicotinicacidmethylester,methyl-4-aminonicotinate,ksc493a3l,tpc-py097 PubChem CID: 592353 IUPAC Name: methyl 4-aminopyridine-3-carboxylate SMILES: COC(=O)C1=C(N)C=CN=C1
| PubChem CID | 592353 |
|---|---|
| CAS | 16135-36-7 |
| Molecular Weight (g/mol) | 152.15 |
| MDL Number | MFCD00955996 |
| SMILES | COC(=O)C1=C(N)C=CN=C1 |
| Synonym | methyl 4-aminonicotinate,4-aminonicotinic acid methyl ester,4-amino-nicotinic acid methyl ester,4-aminopyridine-3-carboxylic acid methyl ester,3-pyridinecarboxylic acid, 4-amino-, methyl ester,nicotinic acid, 4-amino-, methyl ester,4-aminonicotinicacidmethylester,methyl-4-aminonicotinate,ksc493a3l,tpc-py097 |
| IUPAC Name | methyl 4-aminopyridine-3-carboxylate |
| InChI Key | OCARFFAPQGYGBP-UHFFFAOYSA-N |
| Molecular Formula | C7H8N2O2 |
Methyl 2-Chloro-6-methylisonicotinate 97.0+%, TCI America™
CAS: 3998-90-1 Molecular Formula: C8H8ClNO2 Molecular Weight (g/mol): 185.61 MDL Number: MFCD04038391 InChI Key: BDWMGYZSQKGUFA-UHFFFAOYSA-N Synonym: methyl 2-chloro-6-methylisonicotinate,methyl 2-chloro-6-picoline-4-carboxylate,2-chloro-6-picoline-4-carboxylic acid methyl ester,2-chloro-6-methylpyridine-4-carboxylic acid methyl ester,2-chloro-4-methoxycarbonyl-6-methylpyridine,methyl 6-chloro-2-methylpyridine-4-carboxylate,2-chloro-6-methylisonicotinic acid methyl ester,2-chloro-6-methyl pyridine-4-carboxylic acid methyl ester,4-pyridinecarboxylic acid, 2-chloro-6-methyl-, methyl ester,pubchem17060 PubChem CID: 2759833 IUPAC Name: methyl 2-chloro-6-methylpyridine-4-carboxylate SMILES: COC(=O)C1=CC(C)=NC(Cl)=C1
| PubChem CID | 2759833 |
|---|---|
| CAS | 3998-90-1 |
| Molecular Weight (g/mol) | 185.61 |
| MDL Number | MFCD04038391 |
| SMILES | COC(=O)C1=CC(C)=NC(Cl)=C1 |
| Synonym | methyl 2-chloro-6-methylisonicotinate,methyl 2-chloro-6-picoline-4-carboxylate,2-chloro-6-picoline-4-carboxylic acid methyl ester,2-chloro-6-methylpyridine-4-carboxylic acid methyl ester,2-chloro-4-methoxycarbonyl-6-methylpyridine,methyl 6-chloro-2-methylpyridine-4-carboxylate,2-chloro-6-methylisonicotinic acid methyl ester,2-chloro-6-methyl pyridine-4-carboxylic acid methyl ester,4-pyridinecarboxylic acid, 2-chloro-6-methyl-, methyl ester,pubchem17060 |
| IUPAC Name | methyl 2-chloro-6-methylpyridine-4-carboxylate |
| InChI Key | BDWMGYZSQKGUFA-UHFFFAOYSA-N |
| Molecular Formula | C8H8ClNO2 |
2-Methylthio-4-pyrimidinol 98.0+%, TCI America™
CAS: 5751-20-2 Molecular Formula: C5H6N2OS Molecular Weight (g/mol): 142.176 MDL Number: MFCD00047373 InChI Key: UYHSQVMHSFXUOA-UHFFFAOYSA-N Synonym: 2-methylthio pyrimidin-4-ol,2-methylthiopyrimidin-4-ol,2-methylthio-4-pyrimidinol,2-methylthio pyrimidin-4 3h-one,2-methylthio-4-pyrimidone,2-methylthiouracil,2-methylsulfanyl pyrimidin-4-ol,2-methylthio-4-hydroxypyrimidine,4 1h-pyrimidinone, 2-methylthio PubChem CID: 79823 IUPAC Name: 2-methylsulfanyl-1H-pyrimidin-6-one SMILES: CSC1=NC=CC(=O)N1
| PubChem CID | 79823 |
|---|---|
| CAS | 5751-20-2 |
| Molecular Weight (g/mol) | 142.176 |
| MDL Number | MFCD00047373 |
| SMILES | CSC1=NC=CC(=O)N1 |
| Synonym | 2-methylthio pyrimidin-4-ol,2-methylthiopyrimidin-4-ol,2-methylthio-4-pyrimidinol,2-methylthio pyrimidin-4 3h-one,2-methylthio-4-pyrimidone,2-methylthiouracil,2-methylsulfanyl pyrimidin-4-ol,2-methylthio-4-hydroxypyrimidine,4 1h-pyrimidinone, 2-methylthio |
| IUPAC Name | 2-methylsulfanyl-1H-pyrimidin-6-one |
| InChI Key | UYHSQVMHSFXUOA-UHFFFAOYSA-N |
| Molecular Formula | C5H6N2OS |
3-Methyl-2-furancarboxylic Acid 98.0+%, TCI America™
CAS: 4412-96-8 Molecular Formula: C6H6O3 Molecular Weight (g/mol): 126.11 MDL Number: MFCD00014111 InChI Key: BNYIQEFWGSXIKQ-UHFFFAOYSA-N Synonym: 3-methyl-2-furoic acid,2-furancarboxylic acid, 3-methyl,3-methyl-2-furancarboxylic acid,unii-5jp68392hm,3-methyl-furan-2-carboxylic acid,3-methyl-2-furoicacid,methylpyromucic acid,3-methyl furoic acid,3-methylpyromucic acid,acmc-20a5im PubChem CID: 78127 IUPAC Name: 3-methylfuran-2-carboxylic acid SMILES: CC1=C(OC=C1)C(O)=O
| PubChem CID | 78127 |
|---|---|
| CAS | 4412-96-8 |
| Molecular Weight (g/mol) | 126.11 |
| MDL Number | MFCD00014111 |
| SMILES | CC1=C(OC=C1)C(O)=O |
| Synonym | 3-methyl-2-furoic acid,2-furancarboxylic acid, 3-methyl,3-methyl-2-furancarboxylic acid,unii-5jp68392hm,3-methyl-furan-2-carboxylic acid,3-methyl-2-furoicacid,methylpyromucic acid,3-methyl furoic acid,3-methylpyromucic acid,acmc-20a5im |
| IUPAC Name | 3-methylfuran-2-carboxylic acid |
| InChI Key | BNYIQEFWGSXIKQ-UHFFFAOYSA-N |
| Molecular Formula | C6H6O3 |
3-Methyl-6-nitroindazole 98.0+%, TCI America™
CAS: 6494-19-5 Molecular Formula: C8H7N3O2 Molecular Weight (g/mol): 177.163 MDL Number: MFCD07082704 InChI Key: FUNWSYKLFDLUIZ-UHFFFAOYSA-N Synonym: 3-methyl-6-nitro-1h-indazole,3-methyl-6-nitroindazole,1h-indazole, 3-methyl-6-nitro,3-methyl-6-nitro-indazole,pubchem9492,pubchem18398,6-nitro-3-methylindazole,ksc352s0d,2h-indazole,3-methyl-6-nitro PubChem CID: 10921054 IUPAC Name: 3-methyl-6-nitro-2H-indazole SMILES: CC1=C2C=CC(=CC2=NN1)[N+](=O)[O-]
| PubChem CID | 10921054 |
|---|---|
| CAS | 6494-19-5 |
| Molecular Weight (g/mol) | 177.163 |
| MDL Number | MFCD07082704 |
| SMILES | CC1=C2C=CC(=CC2=NN1)[N+](=O)[O-] |
| Synonym | 3-methyl-6-nitro-1h-indazole,3-methyl-6-nitroindazole,1h-indazole, 3-methyl-6-nitro,3-methyl-6-nitro-indazole,pubchem9492,pubchem18398,6-nitro-3-methylindazole,ksc352s0d,2h-indazole,3-methyl-6-nitro |
| IUPAC Name | 3-methyl-6-nitro-2H-indazole |
| InChI Key | FUNWSYKLFDLUIZ-UHFFFAOYSA-N |
| Molecular Formula | C8H7N3O2 |