Organoheterocyclic compounds
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1-Ethyl-3-methylimidazolium Chloride 98.0+%, TCI America™
CAS: 65039-09-0 Molecular Formula: C6H11ClN2 Molecular Weight (g/mol): 146.62 MDL Number: MFCD00074843 InChI Key: BMQZYMYBQZGEEY-UHFFFAOYSA-M Synonym: 1-ethyl-3-methylimidazolium chloride,1-ethyl-3-methyl-1h-imidazol-3-ium chloride,emim cl,unii-ph90aq1e93,1-ethyl-3-methylimidazoliumchloride,1-methyl-3-ethylimidazolium chloride,1-ethyl-3-methylimidazol-3-ium chloride,emim-cl,basionics™ st 80,dsstox_cid_21180 PubChem CID: 2734160 ChEBI: CHEBI:61327 IUPAC Name: 1-ethyl-3-methyl-1H-imidazol-3-ium chloride SMILES: [Cl-].CCN1C=C[N+](C)=C1
| PubChem CID | 2734160 |
|---|---|
| CAS | 65039-09-0 |
| Molecular Weight (g/mol) | 146.62 |
| ChEBI | CHEBI:61327 |
| MDL Number | MFCD00074843 |
| SMILES | [Cl-].CCN1C=C[N+](C)=C1 |
| Synonym | 1-ethyl-3-methylimidazolium chloride,1-ethyl-3-methyl-1h-imidazol-3-ium chloride,emim cl,unii-ph90aq1e93,1-ethyl-3-methylimidazoliumchloride,1-methyl-3-ethylimidazolium chloride,1-ethyl-3-methylimidazol-3-ium chloride,emim-cl,basionics™ st 80,dsstox_cid_21180 |
| IUPAC Name | 1-ethyl-3-methyl-1H-imidazol-3-ium chloride |
| InChI Key | BMQZYMYBQZGEEY-UHFFFAOYSA-M |
| Molecular Formula | C6H11ClN2 |
Ethyl Pyrazole-3-carboxylate 98.0+%, TCI America™
CAS: 5932-27-4 Molecular Formula: C6H8N2O2 Molecular Weight (g/mol): 140.142 MDL Number: MFCD00159643 InChI Key: MSPOSRHJXMILNK-UHFFFAOYSA-N Synonym: Pyrazole-3-carboxylic Acid Ethyl Ester PubChem CID: 7147518 IUPAC Name: ethyl 1H-pyrazole-5-carboxylate SMILES: CCOC(=O)C1=CC=NN1
| PubChem CID | 7147518 |
|---|---|
| CAS | 5932-27-4 |
| Molecular Weight (g/mol) | 140.142 |
| MDL Number | MFCD00159643 |
| SMILES | CCOC(=O)C1=CC=NN1 |
| Synonym | Pyrazole-3-carboxylic Acid Ethyl Ester |
| IUPAC Name | ethyl 1H-pyrazole-5-carboxylate |
| InChI Key | MSPOSRHJXMILNK-UHFFFAOYSA-N |
| Molecular Formula | C6H8N2O2 |
1-Ethyl-1-methylpyrrolidinium Tetrafluoroborate 98.0+%, TCI America™
CAS: 117947-85-0 Molecular Formula: C7H16BF4N Molecular Weight (g/mol): 201.016 MDL Number: MFCD08458505 InChI Key: LAGDCVJRCOKWTN-UHFFFAOYSA-N PubChem CID: 18374068 IUPAC Name: 1-ethyl-1-methylpyrrolidin-1-ium;tetrafluoroborate SMILES: [B-](F)(F)(F)F.CC[N+]1(CCCC1)C
| PubChem CID | 18374068 |
|---|---|
| CAS | 117947-85-0 |
| Molecular Weight (g/mol) | 201.016 |
| MDL Number | MFCD08458505 |
| SMILES | [B-](F)(F)(F)F.CC[N+]1(CCCC1)C |
| IUPAC Name | 1-ethyl-1-methylpyrrolidin-1-ium;tetrafluoroborate |
| InChI Key | LAGDCVJRCOKWTN-UHFFFAOYSA-N |
| Molecular Formula | C7H16BF4N |
Ethyl 2-Chloro-6-methylisonicotinate 98.0+%, TCI America™
CAS: 3998-88-7 Molecular Formula: C9H10ClNO2 Molecular Weight (g/mol): 199.634 MDL Number: MFCD09842151 InChI Key: UMAAIDIASQFLTF-UHFFFAOYSA-N Synonym: ethyl 2-chloro-6-methylisonicotinate,2-chloro-6-methylpyridine-4-carboxylic acid ethyl ester,2-chloro-6-methylisonicotinic acid ethyl ester,ethyl 2-chloro-6-methyl-4-pyridinecarboxylate,ethyl2-chloro-6-methylpyridine-4-carboxylate,2-chloro-6-methyl-isonicotinic acid ethyl ester,4-pyridinecarboxylicacid, 2-chloro-6-methyl-, ethyl ester,2-chloro-6-methylpyridine-4-carboxylic acid ethyl ester; ethyl 2-chloro-6-methylisonicotinate PubChem CID: 22625009 IUPAC Name: ethyl 2-chloro-6-methylpyridine-4-carboxylate SMILES: CCOC(=O)C1=CC(=NC(=C1)Cl)C
| PubChem CID | 22625009 |
|---|---|
| CAS | 3998-88-7 |
| Molecular Weight (g/mol) | 199.634 |
| MDL Number | MFCD09842151 |
| SMILES | CCOC(=O)C1=CC(=NC(=C1)Cl)C |
| Synonym | ethyl 2-chloro-6-methylisonicotinate,2-chloro-6-methylpyridine-4-carboxylic acid ethyl ester,2-chloro-6-methylisonicotinic acid ethyl ester,ethyl 2-chloro-6-methyl-4-pyridinecarboxylate,ethyl2-chloro-6-methylpyridine-4-carboxylate,2-chloro-6-methyl-isonicotinic acid ethyl ester,4-pyridinecarboxylicacid, 2-chloro-6-methyl-, ethyl ester,2-chloro-6-methylpyridine-4-carboxylic acid ethyl ester; ethyl 2-chloro-6-methylisonicotinate |
| IUPAC Name | ethyl 2-chloro-6-methylpyridine-4-carboxylate |
| InChI Key | UMAAIDIASQFLTF-UHFFFAOYSA-N |
| Molecular Formula | C9H10ClNO2 |
3,6-Diiodocarbazole 98.0+%, TCI America™
CAS: 57103-02-3 Molecular Formula: C12H7I2N Molecular Weight (g/mol): 419.00 MDL Number: MFCD00450017 InChI Key: PECAOKZHORDWAI-UHFFFAOYSA-N PubChem CID: 3116488 IUPAC Name: 3,6-diiodo-9H-carbazole SMILES: IC1=CC2=C(NC3=C2C=C(I)C=C3)C=C1
| PubChem CID | 3116488 |
|---|---|
| CAS | 57103-02-3 |
| Molecular Weight (g/mol) | 419.00 |
| MDL Number | MFCD00450017 |
| SMILES | IC1=CC2=C(NC3=C2C=C(I)C=C3)C=C1 |
| IUPAC Name | 3,6-diiodo-9H-carbazole |
| InChI Key | PECAOKZHORDWAI-UHFFFAOYSA-N |
| Molecular Formula | C12H7I2N |
3,6-Dibromo-9-(4-bromophenyl)carbazole 98.0+%, TCI America™
CAS: 73087-83-9 Molecular Formula: C18H10Br3N Molecular Weight (g/mol): 480.00 MDL Number: MFCD12024284 InChI Key: NRTDFHUSNYJENJ-UHFFFAOYSA-N PubChem CID: 11059889 IUPAC Name: 3,6-dibromo-9-(4-bromophenyl)-9H-carbazole SMILES: BrC1=CC=C(C=C1)N1C2=C(C=C(Br)C=C2)C2=C1C=CC(Br)=C2
| PubChem CID | 11059889 |
|---|---|
| CAS | 73087-83-9 |
| Molecular Weight (g/mol) | 480.00 |
| MDL Number | MFCD12024284 |
| SMILES | BrC1=CC=C(C=C1)N1C2=C(C=C(Br)C=C2)C2=C1C=CC(Br)=C2 |
| IUPAC Name | 3,6-dibromo-9-(4-bromophenyl)-9H-carbazole |
| InChI Key | NRTDFHUSNYJENJ-UHFFFAOYSA-N |
| Molecular Formula | C18H10Br3N |
3,6-Diiodo-9-phenylcarbazole 98.0+%, TCI America™
CAS: 57103-21-6 Molecular Formula: C18H11I2N Molecular Weight (g/mol): 495.102 MDL Number: MFCD11521285 InChI Key: AWGAUYXFWGUFNE-UHFFFAOYSA-N PubChem CID: 13407347 IUPAC Name: 3,6-diiodo-9-phenylcarbazole SMILES: C1=CC=C(C=C1)N2C3=C(C=C(C=C3)I)C4=C2C=CC(=C4)I
| PubChem CID | 13407347 |
|---|---|
| CAS | 57103-21-6 |
| Molecular Weight (g/mol) | 495.102 |
| MDL Number | MFCD11521285 |
| SMILES | C1=CC=C(C=C1)N2C3=C(C=C(C=C3)I)C4=C2C=CC(=C4)I |
| IUPAC Name | 3,6-diiodo-9-phenylcarbazole |
| InChI Key | AWGAUYXFWGUFNE-UHFFFAOYSA-N |
| Molecular Formula | C18H11I2N |
2,6-Dibromo-N,N'-bis(2-ethylhexyl)-1,8:4,5-naphthalenetetracarboxdiimide 98.0+%, TCI America™
CAS: 1088205-02-0 Molecular Formula: C30H36Br2N2O4 Molecular Weight (g/mol): 648.44 MDL Number: MFCD27923032 InChI Key: IMWDVKCSASRBSW-UHFFFAOYNA-N PubChem CID: 71721476 IUPAC Name: 2,9-dibromo-6,13-bis(2-ethylhexyl)-6,13-diazatetracyclo[6.6.2.0⁴,¹⁶.0¹¹,¹⁵]hexadeca-1,3,8,10,15-pentaene-5,7,12,14-tetrone SMILES: CCCCC(CC)CN1C(=O)C2=CC(Br)=C3C(=O)N(CC(CC)CCCC)C(=O)C4=CC(Br)=C(C1=O)C2=C34
| PubChem CID | 71721476 |
|---|---|
| CAS | 1088205-02-0 |
| Molecular Weight (g/mol) | 648.44 |
| MDL Number | MFCD27923032 |
| SMILES | CCCCC(CC)CN1C(=O)C2=CC(Br)=C3C(=O)N(CC(CC)CCCC)C(=O)C4=CC(Br)=C(C1=O)C2=C34 |
| IUPAC Name | 2,9-dibromo-6,13-bis(2-ethylhexyl)-6,13-diazatetracyclo[6.6.2.0⁴,¹⁶.0¹¹,¹⁵]hexadeca-1,3,8,10,15-pentaene-5,7,12,14-tetrone |
| InChI Key | IMWDVKCSASRBSW-UHFFFAOYNA-N |
| Molecular Formula | C30H36Br2N2O4 |
2,5-Dibromothiophene-3-carboxylic Acid 96.0+%, TCI America™
CAS: 7311-70-8 Molecular Formula: C5H2Br2O2S Molecular Weight (g/mol): 285.94 MDL Number: MFCD08445656 InChI Key: PZBUYFPAASJYSI-UHFFFAOYSA-N Synonym: 2,5-Dibromo-3-thenoic Acid PubChem CID: 268907 IUPAC Name: 2,5-dibromothiophene-3-carboxylic acid SMILES: OC(=O)C1=C(Br)SC(Br)=C1
| PubChem CID | 268907 |
|---|---|
| CAS | 7311-70-8 |
| Molecular Weight (g/mol) | 285.94 |
| MDL Number | MFCD08445656 |
| SMILES | OC(=O)C1=C(Br)SC(Br)=C1 |
| Synonym | 2,5-Dibromo-3-thenoic Acid |
| IUPAC Name | 2,5-dibromothiophene-3-carboxylic acid |
| InChI Key | PZBUYFPAASJYSI-UHFFFAOYSA-N |
| Molecular Formula | C5H2Br2O2S |
2-Deoxy-2-fluoro-1,3,5-tri-O-benzoyl-alpha-D-arabinofuranose 98.0+%, TCI America™
CAS: 97614-43-2 Molecular Formula: C26H21FO7 Molecular Weight (g/mol): 464.445 MDL Number: MFCD00083339 InChI Key: JOAHVPNLVYCSAN-UXGLMHHASA-N Synonym: 2-deoxy-2-fluoro-1,3,5-tri-o-benzoyl-alpha-d-arabinofuranose,2r,3s,4r,5r-5-benzoyloxy methyl-3-fluorotetrahydrofuran-2,4-diyl dibenzoate,2-deoxy-2-fluoro-1,3,5-tri-o-benzoyl-,a-d-arabinofuranose,1,3,5-tri-o-benzoyl-2-deoxy-2-fluoro-a-d-arabinofuranose,2r,3r,4s,5r-3,5-bis benzoyloxy-4-fluorooxolan-2-yl methyl benzoate,2r,3s,4r,5r-5-benzoyloxymethyl-3-fluoro-tetrahydrofuran-2,4-diyl dibenzoate,1,3,5-tri-o-benzoyl-2-deoxy-2-fluoro-md-arabinose,2-deoxy-2-fluoro-1,3,5-tri-o-benzoyl-d-ribofuranose,pubchem20401,2-deoxy-2-fluoro-1,3,5-tri-o-benzoyl-alpha-d-ribofuranose PubChem CID: 11754171 IUPAC Name: [(2R,3R,4S,5R)-3,5-dibenzoyloxy-4-fluorooxolan-2-yl]methyl benzoate SMILES: C1=CC=C(C=C1)C(=O)OCC2C(C(C(O2)OC(=O)C3=CC=CC=C3)F)OC(=O)C4=CC=CC=C4
| PubChem CID | 11754171 |
|---|---|
| CAS | 97614-43-2 |
| Molecular Weight (g/mol) | 464.445 |
| MDL Number | MFCD00083339 |
| SMILES | C1=CC=C(C=C1)C(=O)OCC2C(C(C(O2)OC(=O)C3=CC=CC=C3)F)OC(=O)C4=CC=CC=C4 |
| Synonym | 2-deoxy-2-fluoro-1,3,5-tri-o-benzoyl-alpha-d-arabinofuranose,2r,3s,4r,5r-5-benzoyloxy methyl-3-fluorotetrahydrofuran-2,4-diyl dibenzoate,2-deoxy-2-fluoro-1,3,5-tri-o-benzoyl-,a-d-arabinofuranose,1,3,5-tri-o-benzoyl-2-deoxy-2-fluoro-a-d-arabinofuranose,2r,3r,4s,5r-3,5-bis benzoyloxy-4-fluorooxolan-2-yl methyl benzoate,2r,3s,4r,5r-5-benzoyloxymethyl-3-fluoro-tetrahydrofuran-2,4-diyl dibenzoate,1,3,5-tri-o-benzoyl-2-deoxy-2-fluoro-md-arabinose,2-deoxy-2-fluoro-1,3,5-tri-o-benzoyl-d-ribofuranose,pubchem20401,2-deoxy-2-fluoro-1,3,5-tri-o-benzoyl-alpha-d-ribofuranose |
| IUPAC Name | [(2R,3R,4S,5R)-3,5-dibenzoyloxy-4-fluorooxolan-2-yl]methyl benzoate |
| InChI Key | JOAHVPNLVYCSAN-UXGLMHHASA-N |
| Molecular Formula | C26H21FO7 |
Diethyl 3,5-Pyridinedicarboxylate 98.0+%, TCI America™
CAS: 4591-56-4 Molecular Formula: C11H13NO4 Molecular Weight (g/mol): 223.228 MDL Number: MFCD00085755 InChI Key: PGGQCHVPWSXPSI-UHFFFAOYSA-N Synonym: 3,5-Pyridinedicarboxylic Acid Diethyl Ester PubChem CID: 78340 IUPAC Name: diethyl pyridine-3,5-dicarboxylate SMILES: CCOC(=O)C1=CC(=CN=C1)C(=O)OCC
| PubChem CID | 78340 |
|---|---|
| CAS | 4591-56-4 |
| Molecular Weight (g/mol) | 223.228 |
| MDL Number | MFCD00085755 |
| SMILES | CCOC(=O)C1=CC(=CN=C1)C(=O)OCC |
| Synonym | 3,5-Pyridinedicarboxylic Acid Diethyl Ester |
| IUPAC Name | diethyl pyridine-3,5-dicarboxylate |
| InChI Key | PGGQCHVPWSXPSI-UHFFFAOYSA-N |
| Molecular Formula | C11H13NO4 |
Resorufin 95.0+%, TCI America™
CAS: 635-78-9 Molecular Formula: C12H7NO3 Molecular Weight (g/mol): 213.19 MDL Number: MFCD00128991 InChI Key: HSSLDCABUXLXKM-UHFFFAOYSA-N Synonym: resorufin,resorufine,7-hydroxy-3h-phenoxazin-3-one,3h-phenoxazin-3-one, 7-hydroxy,7-hydroxy-3h-phenoxazine-3-one,hydroxyphenazone,us9216974,resorufin,4-27-00-02263 beilstein handbook reference,resorufin, dye content 95 % PubChem CID: 69462 ChEBI: CHEBI:51602 IUPAC Name: 7-hydroxy-3H-phenoxazin-3-one SMILES: OC1=CC=C2N=C3C=CC(=O)C=C3OC2=C1
| PubChem CID | 69462 |
|---|---|
| CAS | 635-78-9 |
| Molecular Weight (g/mol) | 213.19 |
| ChEBI | CHEBI:51602 |
| MDL Number | MFCD00128991 |
| SMILES | OC1=CC=C2N=C3C=CC(=O)C=C3OC2=C1 |
| Synonym | resorufin,resorufine,7-hydroxy-3h-phenoxazin-3-one,3h-phenoxazin-3-one, 7-hydroxy,7-hydroxy-3h-phenoxazine-3-one,hydroxyphenazone,us9216974,resorufin,4-27-00-02263 beilstein handbook reference,resorufin, dye content 95 % |
| IUPAC Name | 7-hydroxy-3H-phenoxazin-3-one |
| InChI Key | HSSLDCABUXLXKM-UHFFFAOYSA-N |
| Molecular Formula | C12H7NO3 |
4,5-Ethylenedithio-1,3-dithiole-2-thione 98.0+%, TCI America™
CAS: 59089-89-3 Molecular Formula: C5H4S5 Molecular Weight (g/mol): 224.387 MDL Number: MFCD00137882 InChI Key: LFPIFRGVCYRUEO-UHFFFAOYSA-N PubChem CID: 360963 IUPAC Name: 5,6-dihydro-[1,3]dithiolo[4,5-b][1,4]dithiine-2-thione SMILES: C1CSC2=C(S1)SC(=S)S2
| PubChem CID | 360963 |
|---|---|
| CAS | 59089-89-3 |
| Molecular Weight (g/mol) | 224.387 |
| MDL Number | MFCD00137882 |
| SMILES | C1CSC2=C(S1)SC(=S)S2 |
| IUPAC Name | 5,6-dihydro-[1,3]dithiolo[4,5-b][1,4]dithiine-2-thione |
| InChI Key | LFPIFRGVCYRUEO-UHFFFAOYSA-N |
| Molecular Formula | C5H4S5 |
4-Ethylpyridine 98.0+%, TCI America™
CAS: 536-75-4 Molecular Formula: C7H9N Molecular Weight (g/mol): 107.156 MDL Number: MFCD00006450 InChI Key: VJXRKZJMGVSXPX-UHFFFAOYSA-N Synonym: pyridine, 4-ethyl,.gamma.-ethylpyridine,4-ethyl pyridine,unii-3kw0se2tl5,4-ethyl-pyridine,pyridine, c1-3-alkyl derivs.,3kw0se2tl5,gamma-ethylpyridine,c1-c3 alkylpyridine,4ethylpyridine PubChem CID: 10822 IUPAC Name: 4-ethylpyridine SMILES: CCC1=CC=NC=C1
| PubChem CID | 10822 |
|---|---|
| CAS | 536-75-4 |
| Molecular Weight (g/mol) | 107.156 |
| MDL Number | MFCD00006450 |
| SMILES | CCC1=CC=NC=C1 |
| Synonym | pyridine, 4-ethyl,.gamma.-ethylpyridine,4-ethyl pyridine,unii-3kw0se2tl5,4-ethyl-pyridine,pyridine, c1-3-alkyl derivs.,3kw0se2tl5,gamma-ethylpyridine,c1-c3 alkylpyridine,4ethylpyridine |
| IUPAC Name | 4-ethylpyridine |
| InChI Key | VJXRKZJMGVSXPX-UHFFFAOYSA-N |
| Molecular Formula | C7H9N |