Organoheterocyclic compounds
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Diethyl 2-Propyl-1H-imidazole-4,5-dicarboxylate 98.0+%, TCI America™
CAS: 144689-94-1 Molecular Formula: C12H18N2O4 Molecular Weight (g/mol): 254.286 MDL Number: MFCD08062365 InChI Key: ZQPMIDPIXSMOAD-UHFFFAOYSA-N Synonym: 2-Propyl-1H-imidazole-4,5-dicarboxylic Acid Diethyl Ester PubChem CID: 10286015 IUPAC Name: diethyl 2-propyl-1H-imidazole-4,5-dicarboxylate SMILES: CCCC1=NC(=C(N1)C(=O)OCC)C(=O)OCC
| PubChem CID | 10286015 |
|---|---|
| CAS | 144689-94-1 |
| Molecular Weight (g/mol) | 254.286 |
| MDL Number | MFCD08062365 |
| SMILES | CCCC1=NC(=C(N1)C(=O)OCC)C(=O)OCC |
| Synonym | 2-Propyl-1H-imidazole-4,5-dicarboxylic Acid Diethyl Ester |
| IUPAC Name | diethyl 2-propyl-1H-imidazole-4,5-dicarboxylate |
| InChI Key | ZQPMIDPIXSMOAD-UHFFFAOYSA-N |
| Molecular Formula | C12H18N2O4 |
2,3:4,5-Di-O-isopropylidene-beta-D-fructopyranose 98.0+%, TCI America™
CAS: 20880-92-6 Molecular Formula: C12H20O6 Molecular Weight (g/mol): 260.286 MDL Number: MFCD00022183 InChI Key: PSSHGMIAIUYOJF-OZFQHSNDSA-N Synonym: 2,3:4,5-bis-o-1,2 methylethylidene-beta-d-fruetopyranose PubChem CID: 45357248 IUPAC Name: [(3aR,5aS,8aS)-2,2,7,7-tetramethyl-5,5a,8a,8b-tetrahydrodi[1,3]dioxolo[4,5-a SMILES: CC1(OC2COC3(C(C2O1)OC(O3)(C)C)CO)C
| PubChem CID | 45357248 |
|---|---|
| CAS | 20880-92-6 |
| Molecular Weight (g/mol) | 260.286 |
| MDL Number | MFCD00022183 |
| SMILES | CC1(OC2COC3(C(C2O1)OC(O3)(C)C)CO)C |
| Synonym | 2,3:4,5-bis-o-1,2 methylethylidene-beta-d-fruetopyranose |
| IUPAC Name | [(3aR,5aS,8aS)-2,2,7,7-tetramethyl-5,5a,8a,8b-tetrahydrodi[1,3]dioxolo[4,5-a |
| InChI Key | PSSHGMIAIUYOJF-OZFQHSNDSA-N |
| Molecular Formula | C12H20O6 |
3,6-Dibromo-9-hexyl-9H-carbazole 98.0+%, TCI America™
CAS: 150623-72-6 Molecular Formula: C18H19Br2N Molecular Weight (g/mol): 409.17 MDL Number: MFCD23099108 InChI Key: POMJRCRJZRALHK-UHFFFAOYSA-N PubChem CID: 12174281 IUPAC Name: 3,6-dibromo-9-hexyl-9H-carbazole SMILES: CCCCCCN1C2=C(C=C(Br)C=C2)C2=C1C=CC(Br)=C2
| PubChem CID | 12174281 |
|---|---|
| CAS | 150623-72-6 |
| Molecular Weight (g/mol) | 409.17 |
| MDL Number | MFCD23099108 |
| SMILES | CCCCCCN1C2=C(C=C(Br)C=C2)C2=C1C=CC(Br)=C2 |
| IUPAC Name | 3,6-dibromo-9-hexyl-9H-carbazole |
| InChI Key | POMJRCRJZRALHK-UHFFFAOYSA-N |
| Molecular Formula | C18H19Br2N |
2-(3,5-Dinitrophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane 98.0+%, TCI America™
CAS: 428820-95-5 Molecular Formula: C12H15BN2O6 Molecular Weight (g/mol): 294.07 MDL Number: MFCD11504965 InChI Key: SFFDLKOCTJMCCJ-UHFFFAOYSA-N Synonym: 1,3-Dinitro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzene, 3,5-Dinitrophenylboronic Acid Pinacol Ester PubChem CID: 46739239 IUPAC Name: 2-(3,5-dinitrophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane SMILES: B1(OC(C(O1)(C)C)(C)C)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-]
| PubChem CID | 46739239 |
|---|---|
| CAS | 428820-95-5 |
| Molecular Weight (g/mol) | 294.07 |
| MDL Number | MFCD11504965 |
| SMILES | B1(OC(C(O1)(C)C)(C)C)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-] |
| Synonym | 1,3-Dinitro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzene, 3,5-Dinitrophenylboronic Acid Pinacol Ester |
| IUPAC Name | 2-(3,5-dinitrophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane |
| InChI Key | SFFDLKOCTJMCCJ-UHFFFAOYSA-N |
| Molecular Formula | C12H15BN2O6 |
N,N-Dimethyl-1H-imidazole-1-sulfonamide 98.0+%, TCI America™
CAS: 78162-58-0 Molecular Formula: C5H9N3O2S Molecular Weight (g/mol): 175.206 MDL Number: MFCD00955713 InChI Key: YRRWNBMOJMMXQY-UHFFFAOYSA-N Synonym: 1-(Dimethylsulfamoyl)-1H-imidazole PubChem CID: 395751 IUPAC Name: N,N-dimethylimidazole-1-sulfonamide SMILES: CN(C)S(=O)(=O)N1C=CN=C1
| PubChem CID | 395751 |
|---|---|
| CAS | 78162-58-0 |
| Molecular Weight (g/mol) | 175.206 |
| MDL Number | MFCD00955713 |
| SMILES | CN(C)S(=O)(=O)N1C=CN=C1 |
| Synonym | 1-(Dimethylsulfamoyl)-1H-imidazole |
| IUPAC Name | N,N-dimethylimidazole-1-sulfonamide |
| InChI Key | YRRWNBMOJMMXQY-UHFFFAOYSA-N |
| Molecular Formula | C5H9N3O2S |
4-Chloro-2,6-diphenylpyrimidine 98.0+%, TCI America™
CAS: 29509-91-9 Molecular Formula: C16H11ClN2 Molecular Weight (g/mol): 266.728 MDL Number: MFCD00234890 InChI Key: MJDDVTZXYXHTRY-UHFFFAOYSA-N PubChem CID: 582041 IUPAC Name: 4-chloro-2,6-diphenylpyrimidine SMILES: C1=CC=C(C=C1)C2=CC(=NC(=N2)C3=CC=CC=C3)Cl
| PubChem CID | 582041 |
|---|---|
| CAS | 29509-91-9 |
| Molecular Weight (g/mol) | 266.728 |
| MDL Number | MFCD00234890 |
| SMILES | C1=CC=C(C=C1)C2=CC(=NC(=N2)C3=CC=CC=C3)Cl |
| IUPAC Name | 4-chloro-2,6-diphenylpyrimidine |
| InChI Key | MJDDVTZXYXHTRY-UHFFFAOYSA-N |
| Molecular Formula | C16H11ClN2 |
6-Chloro-2,4-diaminopyrimidine 98.0+%, TCI America™
CAS: 156-83-2 Molecular Formula: C4H5ClN4 Molecular Weight (g/mol): 144.562 MDL Number: MFCD00006097 InChI Key: QJIUMVUZDYPQRT-UHFFFAOYSA-N Synonym: 4-chloro-2,6-diaminopyrimidine,2,4-diamino-6-chloropyrimidine,2,6-diamino-4-chloropyrimidine,6-chloro-2,4-diaminopyrimidine,6-chloro-pyrimidine-2,4-diamine,2,4-pyrimidinediamine, 6-chloro,4-chloro-2,6-diamino pyrimidine,2-amino-6-chloro-4-pyrimidinylamine,caap,minoxidil impurity b PubChem CID: 67432 IUPAC Name: 6-chloropyrimidine-2,4-diamine SMILES: C1=C(N=C(N=C1Cl)N)N
| PubChem CID | 67432 |
|---|---|
| CAS | 156-83-2 |
| Molecular Weight (g/mol) | 144.562 |
| MDL Number | MFCD00006097 |
| SMILES | C1=C(N=C(N=C1Cl)N)N |
| Synonym | 4-chloro-2,6-diaminopyrimidine,2,4-diamino-6-chloropyrimidine,2,6-diamino-4-chloropyrimidine,6-chloro-2,4-diaminopyrimidine,6-chloro-pyrimidine-2,4-diamine,2,4-pyrimidinediamine, 6-chloro,4-chloro-2,6-diamino pyrimidine,2-amino-6-chloro-4-pyrimidinylamine,caap,minoxidil impurity b |
| IUPAC Name | 6-chloropyrimidine-2,4-diamine |
| InChI Key | QJIUMVUZDYPQRT-UHFFFAOYSA-N |
| Molecular Formula | C4H5ClN4 |
6-Cyanoindole 98.0+%, TCI America™
CAS: 15861-36-6 Molecular Formula: C9H6N2 Molecular Weight (g/mol): 142.161 MDL Number: MFCD00016732 InChI Key: SZSZDBFJCQKTRG-UHFFFAOYSA-N Synonym: 6-cyanoindole,6-indolecarbonitrile,indole-6-carbonitrile,6-cyano-1h-indole,indole-6-cyano,6-cyano-indole,6-indole carbonitrile,pubchem7239,cyanoindole-6,1h-indol-6-yl cyanide PubChem CID: 85146 IUPAC Name: 1H-indole-6-carbonitrile SMILES: C1=CC(=CC2=C1C=CN2)C#N
| PubChem CID | 85146 |
|---|---|
| CAS | 15861-36-6 |
| Molecular Weight (g/mol) | 142.161 |
| MDL Number | MFCD00016732 |
| SMILES | C1=CC(=CC2=C1C=CN2)C#N |
| Synonym | 6-cyanoindole,6-indolecarbonitrile,indole-6-carbonitrile,6-cyano-1h-indole,indole-6-cyano,6-cyano-indole,6-indole carbonitrile,pubchem7239,cyanoindole-6,1h-indol-6-yl cyanide |
| IUPAC Name | 1H-indole-6-carbonitrile |
| InChI Key | SZSZDBFJCQKTRG-UHFFFAOYSA-N |
| Molecular Formula | C9H6N2 |
1,4-Bis[(1H-imidazol-1-yl)methyl]benzene 98.0+%, TCI America™
CAS: 56643-83-5 Molecular Formula: C14H14N4 Molecular Weight (g/mol): 238.29 MDL Number: MFCD06598031 InChI Key: NKUFFYFOBGGDTP-UHFFFAOYSA-N PubChem CID: 1257389 IUPAC Name: 1-({4-[(1H-imidazol-1-yl)methyl]phenyl}methyl)-1H-imidazole SMILES: C(N1C=CN=C1)C1=CC=C(CN2C=CN=C2)C=C1
| PubChem CID | 1257389 |
|---|---|
| CAS | 56643-83-5 |
| Molecular Weight (g/mol) | 238.29 |
| MDL Number | MFCD06598031 |
| SMILES | C(N1C=CN=C1)C1=CC=C(CN2C=CN=C2)C=C1 |
| IUPAC Name | 1-({4-[(1H-imidazol-1-yl)methyl]phenyl}methyl)-1H-imidazole |
| InChI Key | NKUFFYFOBGGDTP-UHFFFAOYSA-N |
| Molecular Formula | C14H14N4 |
2-Bromo-5-methylthiazole 98.0+%, TCI America™
CAS: 41731-23-1 Molecular Formula: C4H4BrNS Molecular Weight (g/mol): 178.047 MDL Number: MFCD08460610 InChI Key: FJPZHYAYNAUKKA-UHFFFAOYSA-N Synonym: 2-bromo-5-methylthiazole,2-bromo-5-methyl-thiazole,thiazole, 2-bromo-5-methyl,pubchem20436,acmc-209jlg,2-bromo-5-methyl thiazole,ksc493s9j PubChem CID: 21906106 IUPAC Name: 2-bromo-5-methyl-1,3-thiazole SMILES: CC1=CN=C(S1)Br
| PubChem CID | 21906106 |
|---|---|
| CAS | 41731-23-1 |
| Molecular Weight (g/mol) | 178.047 |
| MDL Number | MFCD08460610 |
| SMILES | CC1=CN=C(S1)Br |
| Synonym | 2-bromo-5-methylthiazole,2-bromo-5-methyl-thiazole,thiazole, 2-bromo-5-methyl,pubchem20436,acmc-209jlg,2-bromo-5-methyl thiazole,ksc493s9j |
| IUPAC Name | 2-bromo-5-methyl-1,3-thiazole |
| InChI Key | FJPZHYAYNAUKKA-UHFFFAOYSA-N |
| Molecular Formula | C4H4BrNS |
5-Bromoindole-3-carboxylic Acid 98.0+%, TCI America™
CAS: 10406-06-1 Molecular Formula: C9H6BrNO2 Molecular Weight (g/mol): 240.056 MDL Number: MFCD05664007 InChI Key: JVZMBSGNSAHFCY-UHFFFAOYSA-N Synonym: 5-bromoindole-3-carboxylic acid,5-bromo-indole-3-carboxylic acid,5-bromo-3-indolecarboxylic acid,1h-indole-3-carboxylic acid,5-bromo,1h-indole-3-carboxylic acid, 5-bromo,5-bromo-1h-indole-3-carboxylicacid,pubchem7982,acmc-1btmm,ksc173q4r,5-bromo-3-indolecarboxylicacid PubChem CID: 7018243 IUPAC Name: 5-bromo-1H-indole-3-carboxylic acid SMILES: C1=CC2=C(C=C1Br)C(=CN2)C(=O)O
| PubChem CID | 7018243 |
|---|---|
| CAS | 10406-06-1 |
| Molecular Weight (g/mol) | 240.056 |
| MDL Number | MFCD05664007 |
| SMILES | C1=CC2=C(C=C1Br)C(=CN2)C(=O)O |
| Synonym | 5-bromoindole-3-carboxylic acid,5-bromo-indole-3-carboxylic acid,5-bromo-3-indolecarboxylic acid,1h-indole-3-carboxylic acid,5-bromo,1h-indole-3-carboxylic acid, 5-bromo,5-bromo-1h-indole-3-carboxylicacid,pubchem7982,acmc-1btmm,ksc173q4r,5-bromo-3-indolecarboxylicacid |
| IUPAC Name | 5-bromo-1H-indole-3-carboxylic acid |
| InChI Key | JVZMBSGNSAHFCY-UHFFFAOYSA-N |
| Molecular Formula | C9H6BrNO2 |
N-(Benzoyloxy)succinimide 98.0+%, TCI America™
CAS: 23405-15-4 Molecular Formula: C11H9NO4 Molecular Weight (g/mol): 219.196 MDL Number: MFCD00078953 InChI Key: BVUOEDOMUOJKOY-UHFFFAOYSA-N Synonym: n-benzoyloxy succinimide,bz-osu,n-succinimidyl benzoate,benzoic acid n-hydroxysuccinimide ester,2,5-pyrrolidinedione, 1-benzoyloxy,1-benzoyloxy-2,5-pyrrolidinedione,2,5-dioxoazolidinyl benzoate,1-phenylcarbonyl oxy pyrrolidine-2,5-dione,benzoyoxysuccinimide,benzoic acid succinimidyl ester PubChem CID: 716426 IUPAC Name: (2,5-dioxopyrrolidin-1-yl) benzoate SMILES: C1CC(=O)N(C1=O)OC(=O)C2=CC=CC=C2
| PubChem CID | 716426 |
|---|---|
| CAS | 23405-15-4 |
| Molecular Weight (g/mol) | 219.196 |
| MDL Number | MFCD00078953 |
| SMILES | C1CC(=O)N(C1=O)OC(=O)C2=CC=CC=C2 |
| Synonym | n-benzoyloxy succinimide,bz-osu,n-succinimidyl benzoate,benzoic acid n-hydroxysuccinimide ester,2,5-pyrrolidinedione, 1-benzoyloxy,1-benzoyloxy-2,5-pyrrolidinedione,2,5-dioxoazolidinyl benzoate,1-phenylcarbonyl oxy pyrrolidine-2,5-dione,benzoyoxysuccinimide,benzoic acid succinimidyl ester |
| IUPAC Name | (2,5-dioxopyrrolidin-1-yl) benzoate |
| InChI Key | BVUOEDOMUOJKOY-UHFFFAOYSA-N |
| Molecular Formula | C11H9NO4 |
1-(tert-Butoxycarbonyl)-3-fluoro-4-piperidone 97.0+%, TCI America™
CAS: 211108-50-8 Molecular Formula: C10H16FNO3 Molecular Weight (g/mol): 217.24 MDL Number: MFCD10566554 InChI Key: JZNWQLLPLOQGOI-UHFFFAOYSA-N Synonym: 1-boc-3-fluoro-4-oxopiperidine,3-fluoro-4-oxopiperidine-1-carboxylic acid tert-butyl ester,1-boc-3-fluoro-4-piperidone,1-tert-butoxycarbonyl-3-fluoro-4-piperidone,1-piperidinecarboxylic acid, 3-fluoro-4-oxo-, 1,1-dimethylethyl ester,1-tert-butoxycarbonyl-3-fluoro-4-oxopiperidine,3-fluoro-4-oxo-piperidine-1-carboxylic acid tert-butyl ester,tert-butyl3-fluoro-4-oxopiperidine-1-carboxylate,tert-butyl 3-fluoro-4-oxo-piperidine-1-carboxylate,n-boc-3-fluoro-4-piperidinone PubChem CID: 10560711 IUPAC Name: tert-butyl 3-fluoro-4-oxopiperidine-1-carboxylate SMILES: CC(C)(C)OC(=O)N1CCC(=O)C(C1)F
| PubChem CID | 10560711 |
|---|---|
| CAS | 211108-50-8 |
| Molecular Weight (g/mol) | 217.24 |
| MDL Number | MFCD10566554 |
| SMILES | CC(C)(C)OC(=O)N1CCC(=O)C(C1)F |
| Synonym | 1-boc-3-fluoro-4-oxopiperidine,3-fluoro-4-oxopiperidine-1-carboxylic acid tert-butyl ester,1-boc-3-fluoro-4-piperidone,1-tert-butoxycarbonyl-3-fluoro-4-piperidone,1-piperidinecarboxylic acid, 3-fluoro-4-oxo-, 1,1-dimethylethyl ester,1-tert-butoxycarbonyl-3-fluoro-4-oxopiperidine,3-fluoro-4-oxo-piperidine-1-carboxylic acid tert-butyl ester,tert-butyl3-fluoro-4-oxopiperidine-1-carboxylate,tert-butyl 3-fluoro-4-oxo-piperidine-1-carboxylate,n-boc-3-fluoro-4-piperidinone |
| IUPAC Name | tert-butyl 3-fluoro-4-oxopiperidine-1-carboxylate |
| InChI Key | JZNWQLLPLOQGOI-UHFFFAOYSA-N |
| Molecular Formula | C10H16FNO3 |
4,5-Bis(hydroxymethyl)-2-phenylimidazole 95.0+%, TCI America™
CAS: 61698-32-6 Molecular Formula: C11H12N2O2 Molecular Weight (g/mol): 204.229 MDL Number: MFCD00047017 InChI Key: UUQQGGWZVKUCBD-UHFFFAOYSA-N PubChem CID: 109115 IUPAC Name: [4-(hydroxymethyl)-2-phenyl-1H-imidazol-5-yl]methanol SMILES: C1=CC=C(C=C1)C2=NC(=C(N2)CO)CO
| PubChem CID | 109115 |
|---|---|
| CAS | 61698-32-6 |
| Molecular Weight (g/mol) | 204.229 |
| MDL Number | MFCD00047017 |
| SMILES | C1=CC=C(C=C1)C2=NC(=C(N2)CO)CO |
| IUPAC Name | [4-(hydroxymethyl)-2-phenyl-1H-imidazol-5-yl]methanol |
| InChI Key | UUQQGGWZVKUCBD-UHFFFAOYSA-N |
| Molecular Formula | C11H12N2O2 |
2-(tert-Butoxycarbonyl)-2-azabicyclo[2.2.1]hept-5-ene 95.0+%, TCI America™
CAS: 188345-71-3 Molecular Formula: C11H17NO2 Molecular Weight (g/mol): 195.262 MDL Number: MFCD22416354 InChI Key: ZATXHTCUZAWODK-UHFFFAOYSA-N Synonym: 2-boc-2-azabicyclo 2.2.1 hept-5-ene,tert-butyl 2-aza-bicyclo 2.2.1 hept-5-ene-2-carboxylate,tert-butyl 2-azabicyclo 2.2.1 hept-5-ene-2-carboxylate,2-tert-butoxycarbonyl-2-azabicyclo 2.2.1 hept-5-ene,tert-butyl2-azabicyclo 2.2.1 hept-5-ene-2-carboxylate,ksc497c1n,tert-butyl 5-azabicyclo 2.2.1 hept-2-ene-5-carboxylate,2-aza-bicyclo 2.2.1 hept-5-ene-2-carboxylic acid tert-butyl ester,2-tert-butyloxycarbonyl-2-azabicyclo 2.2.1 hepta-5-ene,2-azabicyclo 2.2.1 hept-5-ene-2-carboxylic acid tert-butyl ester PubChem CID: 15837921 IUPAC Name: tert-butyl 5-azabicyclo[2.2.1]hept-2-ene-5-carboxylate SMILES: CC(C)(C)OC(=O)N1CC2CC1C=C2
| PubChem CID | 15837921 |
|---|---|
| CAS | 188345-71-3 |
| Molecular Weight (g/mol) | 195.262 |
| MDL Number | MFCD22416354 |
| SMILES | CC(C)(C)OC(=O)N1CC2CC1C=C2 |
| Synonym | 2-boc-2-azabicyclo 2.2.1 hept-5-ene,tert-butyl 2-aza-bicyclo 2.2.1 hept-5-ene-2-carboxylate,tert-butyl 2-azabicyclo 2.2.1 hept-5-ene-2-carboxylate,2-tert-butoxycarbonyl-2-azabicyclo 2.2.1 hept-5-ene,tert-butyl2-azabicyclo 2.2.1 hept-5-ene-2-carboxylate,ksc497c1n,tert-butyl 5-azabicyclo 2.2.1 hept-2-ene-5-carboxylate,2-aza-bicyclo 2.2.1 hept-5-ene-2-carboxylic acid tert-butyl ester,2-tert-butyloxycarbonyl-2-azabicyclo 2.2.1 hepta-5-ene,2-azabicyclo 2.2.1 hept-5-ene-2-carboxylic acid tert-butyl ester |
| IUPAC Name | tert-butyl 5-azabicyclo[2.2.1]hept-2-ene-5-carboxylate |
| InChI Key | ZATXHTCUZAWODK-UHFFFAOYSA-N |
| Molecular Formula | C11H17NO2 |