Organoheterocyclic compounds
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1,2-Epoxydodecane 95.0+%, TCI America™
CAS: 2855-19-8 Molecular Formula: C12H24O Molecular Weight (g/mol): 184.323 MDL Number: MFCD00005150 InChI Key: MPGABYXKKCLIRW-UHFFFAOYSA-N Synonym: 1,2-epoxydodecane,1-dodecene oxide,oxirane, decyl,decyloxirane,decyl oxirane,dodecene epoxide,1,2-dodecane oxide,1,2-dodecene oxide,1,2-epoxy-n-dodecene,nedox 1200 PubChem CID: 17858 IUPAC Name: 2-decyloxirane SMILES: CCCCCCCCCCC1CO1
| PubChem CID | 17858 |
|---|---|
| CAS | 2855-19-8 |
| Molecular Weight (g/mol) | 184.323 |
| MDL Number | MFCD00005150 |
| SMILES | CCCCCCCCCCC1CO1 |
| Synonym | 1,2-epoxydodecane,1-dodecene oxide,oxirane, decyl,decyloxirane,decyl oxirane,dodecene epoxide,1,2-dodecane oxide,1,2-dodecene oxide,1,2-epoxy-n-dodecene,nedox 1200 |
| IUPAC Name | 2-decyloxirane |
| InChI Key | MPGABYXKKCLIRW-UHFFFAOYSA-N |
| Molecular Formula | C12H24O |
Ethosuximide 98.0+%, TCI America™
CAS: 77-67-8 Molecular Formula: C7H11NO2 Molecular Weight (g/mol): 141.17 MDL Number: MFCD00072123 InChI Key: HAPOVYFOVVWLRS-UHFFFAOYNA-N Synonym: ethosuximide,zarontin,etosuximida,2-ethyl-2-methylsuccinimide,ethosuxide,ethosuccimide,ethosuccinimide,petnidan,suxinutin,atysmal PubChem CID: 3291 ChEBI: CHEBI:4887 IUPAC Name: 3-ethyl-3-methylpyrrolidine-2,5-dione SMILES: CCC1(C)CC(=O)NC1=O
| PubChem CID | 3291 |
|---|---|
| CAS | 77-67-8 |
| Molecular Weight (g/mol) | 141.17 |
| ChEBI | CHEBI:4887 |
| MDL Number | MFCD00072123 |
| SMILES | CCC1(C)CC(=O)NC1=O |
| Synonym | ethosuximide,zarontin,etosuximida,2-ethyl-2-methylsuccinimide,ethosuxide,ethosuccimide,ethosuccinimide,petnidan,suxinutin,atysmal |
| IUPAC Name | 3-ethyl-3-methylpyrrolidine-2,5-dione |
| InChI Key | HAPOVYFOVVWLRS-UHFFFAOYNA-N |
| Molecular Formula | C7H11NO2 |
Carvedilol 98.0+%, TCI America™
CAS: 72956-09-3 Molecular Formula: C24H26N2O4 Molecular Weight (g/mol): 406.48 MDL Number: MFCD00864692,MFCD00869663 InChI Key: OGHNVEJMJSYVRP-UHFFFAOYNA-N Synonym: carvedilol,coreg,dilatrend,carvedilolum,eucardic,carvedilolum latin,kredex,querto,1-9h-carbazol-4-yloxy-3-2-2-methoxyphenoxy ethyl amino-2-propanol,1-9h-carbazol-4-yl oxy-3-2-2-methoxyphenoxy ethyl amino propan-2-ol PubChem CID: 2585 ChEBI: CHEBI:3441 IUPAC Name: 1-(9H-carbazol-4-yloxy)-3-{[2-(2-methoxyphenoxy)ethyl]amino}propan-2-ol SMILES: COC1=CC=CC=C1OCCNCC(O)COC1=CC=CC2=C1C1=C(N2)C=CC=C1
| PubChem CID | 2585 |
|---|---|
| CAS | 72956-09-3 |
| Molecular Weight (g/mol) | 406.48 |
| ChEBI | CHEBI:3441 |
| MDL Number | MFCD00864692,MFCD00869663 |
| SMILES | COC1=CC=CC=C1OCCNCC(O)COC1=CC=CC2=C1C1=C(N2)C=CC=C1 |
| Synonym | carvedilol,coreg,dilatrend,carvedilolum,eucardic,carvedilolum latin,kredex,querto,1-9h-carbazol-4-yloxy-3-2-2-methoxyphenoxy ethyl amino-2-propanol,1-9h-carbazol-4-yl oxy-3-2-2-methoxyphenoxy ethyl amino propan-2-ol |
| IUPAC Name | 1-(9H-carbazol-4-yloxy)-3-{[2-(2-methoxyphenoxy)ethyl]amino}propan-2-ol |
| InChI Key | OGHNVEJMJSYVRP-UHFFFAOYNA-N |
| Molecular Formula | C24H26N2O4 |
2-Methyl-5-nitroimidazole-1-ethanol 99.0+%, TCI America™
CAS: 443-48-1 Molecular Formula: C6H9N3O3 Molecular Weight (g/mol): 171.156 MDL Number: MFCD00009750 InChI Key: VAOCPAMSLUNLGC-UHFFFAOYSA-N Synonym: metronidazole,metronidazol,flagyl,2-methyl-5-nitroimidazole-1-ethanol,anagiardil,trichazol,gineflavir,meronidal,metronidaz,novonidazol PubChem CID: 4173 ChEBI: CHEBI:6909 IUPAC Name: 2-(2-methyl-5-nitroimidazol-1-yl)ethanol SMILES: CC1=NC=C(N1CCO)[N+](=O)[O-]
| PubChem CID | 4173 |
|---|---|
| CAS | 443-48-1 |
| Molecular Weight (g/mol) | 171.156 |
| ChEBI | CHEBI:6909 |
| MDL Number | MFCD00009750 |
| SMILES | CC1=NC=C(N1CCO)[N+](=O)[O-] |
| Synonym | metronidazole,metronidazol,flagyl,2-methyl-5-nitroimidazole-1-ethanol,anagiardil,trichazol,gineflavir,meronidal,metronidaz,novonidazol |
| IUPAC Name | 2-(2-methyl-5-nitroimidazol-1-yl)ethanol |
| InChI Key | VAOCPAMSLUNLGC-UHFFFAOYSA-N |
| Molecular Formula | C6H9N3O3 |
Guanine 98.0+%, TCI America™
CAS: 73-40-5 Molecular Formula: C5H5N5O Molecular Weight (g/mol): 151.13 MDL Number: MFCD00071533 InChI Key: UYTPUPDQBNUYGX-UHFFFAOYSA-N Synonym: guanine,2-amino-6-hydroxypurine,guanin,2-aminohypoxanthine,mearlmaid,pearl essence,guanine enol,stella polaris,dew pearl,natural pearl essence PubChem CID: 764 ChEBI: CHEBI:16235 IUPAC Name: 2-amino-6,7-dihydro-3H-purin-6-one SMILES: NC1=NC(=O)C2=C(N1)N=CN2
| PubChem CID | 764 |
|---|---|
| CAS | 73-40-5 |
| Molecular Weight (g/mol) | 151.13 |
| ChEBI | CHEBI:16235 |
| MDL Number | MFCD00071533 |
| SMILES | NC1=NC(=O)C2=C(N1)N=CN2 |
| Synonym | guanine,2-amino-6-hydroxypurine,guanin,2-aminohypoxanthine,mearlmaid,pearl essence,guanine enol,stella polaris,dew pearl,natural pearl essence |
| IUPAC Name | 2-amino-6,7-dihydro-3H-purin-6-one |
| InChI Key | UYTPUPDQBNUYGX-UHFFFAOYSA-N |
| Molecular Formula | C5H5N5O |
1-Benzyl-4-piperidone 98.0+%, TCI America™
CAS: 3612-20-2 Molecular Formula: C12H15NO Molecular Weight (g/mol): 189.258 MDL Number: MFCD00006192 InChI Key: SJZKULRDWHPHGG-UHFFFAOYSA-N Synonym: 1-benzyl-4-piperidone,n-benzyl-4-piperidone,4-piperidinone, 1-phenylmethyl,1-benzyl-4-piperidinone,1-benzylpiperidone,1-benzyl-4-oxopiperidine,1-benzyl-piperidin-4-one,n-benzyl-4-piperidine,n-benzyl-4-piperidinone,n-benzylpiperidin-4-one PubChem CID: 19220 IUPAC Name: 1-benzylpiperidin-4-one SMILES: C1CN(CCC1=O)CC2=CC=CC=C2
| PubChem CID | 19220 |
|---|---|
| CAS | 3612-20-2 |
| Molecular Weight (g/mol) | 189.258 |
| MDL Number | MFCD00006192 |
| SMILES | C1CN(CCC1=O)CC2=CC=CC=C2 |
| Synonym | 1-benzyl-4-piperidone,n-benzyl-4-piperidone,4-piperidinone, 1-phenylmethyl,1-benzyl-4-piperidinone,1-benzylpiperidone,1-benzyl-4-oxopiperidine,1-benzyl-piperidin-4-one,n-benzyl-4-piperidine,n-benzyl-4-piperidinone,n-benzylpiperidin-4-one |
| IUPAC Name | 1-benzylpiperidin-4-one |
| InChI Key | SJZKULRDWHPHGG-UHFFFAOYSA-N |
| Molecular Formula | C12H15NO |
4,4'-Dimethyl-2,2'-bipyridyl 98.0+%, TCI America™
CAS: 1134-35-6 Molecular Formula: C12H12N2 Molecular Weight (g/mol): 184.242 MDL Number: MFCD00006441 InChI Key: NBPGPQJFYXNFKN-UHFFFAOYSA-N Synonym: 4,4'-dimethyl-2,2'-bipyridine,4,4'-dimethyl-2,2'-bipyridyl,4,4'-dimethyl-2,2'-dipyridyl,2,2'-bi-4-picoline,2,2'-bipyridine, 4,4'-dimethyl,2,2'-bi gamma-picoline,2,2'-di-4-picolyl,4-methyl-2-4-methylpyridin-2-yl pyridine,2,2'-bipyridyl, 4,4'-dimethyl,4,4-dimethyl-2,2-bipyridyl PubChem CID: 14338 IUPAC Name: 4-methyl-2-(4-methylpyridin-2-yl)pyridine SMILES: CC1=CC(=NC=C1)C2=NC=CC(=C2)C
| PubChem CID | 14338 |
|---|---|
| CAS | 1134-35-6 |
| Molecular Weight (g/mol) | 184.242 |
| MDL Number | MFCD00006441 |
| SMILES | CC1=CC(=NC=C1)C2=NC=CC(=C2)C |
| Synonym | 4,4'-dimethyl-2,2'-bipyridine,4,4'-dimethyl-2,2'-bipyridyl,4,4'-dimethyl-2,2'-dipyridyl,2,2'-bi-4-picoline,2,2'-bipyridine, 4,4'-dimethyl,2,2'-bi gamma-picoline,2,2'-di-4-picolyl,4-methyl-2-4-methylpyridin-2-yl pyridine,2,2'-bipyridyl, 4,4'-dimethyl,4,4-dimethyl-2,2-bipyridyl |
| IUPAC Name | 4-methyl-2-(4-methylpyridin-2-yl)pyridine |
| InChI Key | NBPGPQJFYXNFKN-UHFFFAOYSA-N |
| Molecular Formula | C12H12N2 |
Di(N-succinimidyl) 3,3'-Dithiodipropionate 97.0+%, TCI America™
CAS: 57757-57-0 Molecular Formula: C14H16N2O8S2 Molecular Weight (g/mol): 404.408 MDL Number: MFCD00042045 InChI Key: FXYPGCIGRDZWNR-UHFFFAOYSA-N PubChem CID: 93313 IUPAC Name: (2,5-dioxopyrrolidin-1-yl) 3-[[3-(2,5-dioxopyrrolidin-1-yl)oxy-3-oxopropyl]disulfanyl]propanoate SMILES: C1CC(=O)N(C1=O)OC(=O)CCSSCCC(=O)ON2C(=O)CCC2=O
| PubChem CID | 93313 |
|---|---|
| CAS | 57757-57-0 |
| Molecular Weight (g/mol) | 404.408 |
| MDL Number | MFCD00042045 |
| SMILES | C1CC(=O)N(C1=O)OC(=O)CCSSCCC(=O)ON2C(=O)CCC2=O |
| IUPAC Name | (2,5-dioxopyrrolidin-1-yl) 3-[[3-(2,5-dioxopyrrolidin-1-yl)oxy-3-oxopropyl]disulfanyl]propanoate |
| InChI Key | FXYPGCIGRDZWNR-UHFFFAOYSA-N |
| Molecular Formula | C14H16N2O8S2 |
1,2-Butylene Oxide 99.0+%, TCI America™
CAS: 106-88-7 Molecular Formula: C4H8O Molecular Weight (g/mol): 72.107 MDL Number: MFCD00005153 InChI Key: RBACIKXCRWGCBB-UHFFFAOYSA-N Synonym: 1,2-epoxybutane,1,2-butylene oxide,oxirane, ethyl,ethyloxirane,1,2-butene oxide,ethylethylene oxide,1-butene oxide,oxirane, 2-ethyl,butane, epoxy,1-butylene oxide PubChem CID: 7834 ChEBI: CHEBI:82326 IUPAC Name: 2-ethyloxirane SMILES: CCC1CO1
| PubChem CID | 7834 |
|---|---|
| CAS | 106-88-7 |
| Molecular Weight (g/mol) | 72.107 |
| ChEBI | CHEBI:82326 |
| MDL Number | MFCD00005153 |
| SMILES | CCC1CO1 |
| Synonym | 1,2-epoxybutane,1,2-butylene oxide,oxirane, ethyl,ethyloxirane,1,2-butene oxide,ethylethylene oxide,1-butene oxide,oxirane, 2-ethyl,butane, epoxy,1-butylene oxide |
| IUPAC Name | 2-ethyloxirane |
| InChI Key | RBACIKXCRWGCBB-UHFFFAOYSA-N |
| Molecular Formula | C4H8O |
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 |
Furan-2,5-dicarboxylic acid, 98%
CAS: 3238-40-2 Molecular Formula: C6H4O5 Molecular Weight (g/mol): 156.09 MDL Number: MFCD00016582 InChI Key: CHTHALBTIRVDBM-UHFFFAOYSA-N Synonym: 2,5-furandicarboxylic acid,dehydromucic acid,furan-2,5-dicarbonsaeure,2,5-furandicarboxylicacid,2,5-furandicarboxylate,furane-alpha,alpha'-dicarboxylic acid,furan 2,5-dicarboxylic acid,furan-2,5-dicarboxylate,furane-.alpha.,.alpha.'-dicarboxylic acid,2,5 furan dicarboxylic acid PubChem CID: 76720 ChEBI: CHEBI:84212 IUPAC Name: furan-2,5-dicarboxylic acid SMILES: OC(=O)C1=CC=C(O1)C(O)=O
| PubChem CID | 76720 |
|---|---|
| CAS | 3238-40-2 |
| Molecular Weight (g/mol) | 156.09 |
| ChEBI | CHEBI:84212 |
| MDL Number | MFCD00016582 |
| SMILES | OC(=O)C1=CC=C(O1)C(O)=O |
| Synonym | 2,5-furandicarboxylic acid,dehydromucic acid,furan-2,5-dicarbonsaeure,2,5-furandicarboxylicacid,2,5-furandicarboxylate,furane-alpha,alpha'-dicarboxylic acid,furan 2,5-dicarboxylic acid,furan-2,5-dicarboxylate,furane-.alpha.,.alpha.'-dicarboxylic acid,2,5 furan dicarboxylic acid |
| IUPAC Name | furan-2,5-dicarboxylic acid |
| InChI Key | CHTHALBTIRVDBM-UHFFFAOYSA-N |
| Molecular Formula | C6H4O5 |
2-Methyl-3-furoic acid, 98%
CAS: 6947-94-0 Molecular Formula: C6H6O3 Molecular Weight (g/mol): 126.111 MDL Number: MFCD00092314 InChI Key: CFGQZVOVFIZRMN-UHFFFAOYSA-N PubChem CID: 244756 IUPAC Name: 2-methylfuran-3-carboxylic acid SMILES: CC1=C(C=CO1)C(=O)O
| PubChem CID | 244756 |
|---|---|
| CAS | 6947-94-0 |
| Molecular Weight (g/mol) | 126.111 |
| MDL Number | MFCD00092314 |
| SMILES | CC1=C(C=CO1)C(=O)O |
| IUPAC Name | 2-methylfuran-3-carboxylic acid |
| InChI Key | CFGQZVOVFIZRMN-UHFFFAOYSA-N |
| Molecular Formula | C6H6O3 |
Methyl 5-(chloromethyl)-2-furoate, 95%, Thermo Scientific™
CAS: 2144-37-8 Molecular Formula: C7H7ClO3 Molecular Weight (g/mol): 174.58 MDL Number: MFCD00020922 InChI Key: PWXMEBZOKUPCST-UHFFFAOYSA-N Synonym: methyl 5-chloromethyl-2-furoate,methyl 5-chloromethyl furan-2-carboxylate,methyl 5-chloromethyl-2-furancarboxylate,5-chloromethyl-furan-2-carboxylic acid methyl ester,2-furancarboxylic acid, 5-chloromethyl-, methyl ester,5-chloromethylfuran-2-carboxylic acid methyl ester,pubchem24261,enamine_005466,acmc-1ck5d PubChem CID: 75065 IUPAC Name: methyl 5-(chloromethyl)furan-2-carboxylate SMILES: COC(=O)C1=CC=C(O1)CCl
| PubChem CID | 75065 |
|---|---|
| CAS | 2144-37-8 |
| Molecular Weight (g/mol) | 174.58 |
| MDL Number | MFCD00020922 |
| SMILES | COC(=O)C1=CC=C(O1)CCl |
| Synonym | methyl 5-chloromethyl-2-furoate,methyl 5-chloromethyl furan-2-carboxylate,methyl 5-chloromethyl-2-furancarboxylate,5-chloromethyl-furan-2-carboxylic acid methyl ester,2-furancarboxylic acid, 5-chloromethyl-, methyl ester,5-chloromethylfuran-2-carboxylic acid methyl ester,pubchem24261,enamine_005466,acmc-1ck5d |
| IUPAC Name | methyl 5-(chloromethyl)furan-2-carboxylate |
| InChI Key | PWXMEBZOKUPCST-UHFFFAOYSA-N |
| Molecular Formula | C7H7ClO3 |
Ethyl 7-methoxybenzo[b]furan-2-carboxylate, 97%
CAS: 50551-58-1 Molecular Formula: C12H12O4 Molecular Weight (g/mol): 220.22 MDL Number: MFCD00060510 InChI Key: SXCMZYVXJUJIDJ-UHFFFAOYSA-N PubChem CID: 521284 IUPAC Name: ethyl 7-methoxy-1-benzofuran-2-carboxylate SMILES: CCOC(=O)C1=CC2=CC=CC(OC)=C2O1
| PubChem CID | 521284 |
|---|---|
| CAS | 50551-58-1 |
| Molecular Weight (g/mol) | 220.22 |
| MDL Number | MFCD00060510 |
| SMILES | CCOC(=O)C1=CC2=CC=CC(OC)=C2O1 |
| IUPAC Name | ethyl 7-methoxy-1-benzofuran-2-carboxylate |
| InChI Key | SXCMZYVXJUJIDJ-UHFFFAOYSA-N |
| Molecular Formula | C12H12O4 |
4,5-Dimethyl-2-furoic acid, 97%, Thermo Scientific™
CAS: 89639-83-8 Molecular Formula: C7H8O3 Molecular Weight (g/mol): 140.138 MDL Number: MFCD00085031 InChI Key: BNVXYXRSJIWWDX-UHFFFAOYSA-N PubChem CID: 2774924 IUPAC Name: 4,5-dimethylfuran-2-carboxylic acid SMILES: CC1=C(OC(=C1)C(=O)O)C
| PubChem CID | 2774924 |
|---|---|
| CAS | 89639-83-8 |
| Molecular Weight (g/mol) | 140.138 |
| MDL Number | MFCD00085031 |
| SMILES | CC1=C(OC(=C1)C(=O)O)C |
| IUPAC Name | 4,5-dimethylfuran-2-carboxylic acid |
| InChI Key | BNVXYXRSJIWWDX-UHFFFAOYSA-N |
| Molecular Formula | C7H8O3 |