Organoheterocyclic compounds
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5-Nitroquinoline 98.0+%, TCI America™
CAS: 607-34-1 Molecular Formula: C9H6N2O2 Molecular Weight (g/mol): 174.159 MDL Number: MFCD00006790 InChI Key: NDDZXHOCOKCNBM-UHFFFAOYSA-N Synonym: quinoline, 5-nitro,5-nitro-quinoline,zlchem 399,pubchem5821,acmc-209mlr,5-nitroquinoline,5-20-07-00325 beilstein handbook reference,ksc355k8h,7ze PubChem CID: 11829 IUPAC Name: 5-nitroquinoline SMILES: C1=CC2=C(C=CC=N2)C(=C1)[N+](=O)[O-]
| PubChem CID | 11829 |
|---|---|
| CAS | 607-34-1 |
| Molecular Weight (g/mol) | 174.159 |
| MDL Number | MFCD00006790 |
| SMILES | C1=CC2=C(C=CC=N2)C(=C1)[N+](=O)[O-] |
| Synonym | quinoline, 5-nitro,5-nitro-quinoline,zlchem 399,pubchem5821,acmc-209mlr,5-nitroquinoline,5-20-07-00325 beilstein handbook reference,ksc355k8h,7ze |
| IUPAC Name | 5-nitroquinoline |
| InChI Key | NDDZXHOCOKCNBM-UHFFFAOYSA-N |
| Molecular Formula | C9H6N2O2 |
N-Succinimidyl 3-Maleimidopropionate 98.0+%, TCI America™
CAS: 55750-62-4 Molecular Formula: C11H10N2O6 Molecular Weight (g/mol): 266.209 MDL Number: MFCD00043141 InChI Key: JKHVDAUOODACDU-UHFFFAOYSA-N Synonym: n-succinimidyl 3-maleimidopropionate,2,5-dioxopyrrolidin-1-yl 3-2,5-dioxo-2,5-dihydro-1h-pyrrol-1-yl propanoate,3-maleimido propionic acid n-hydroxysuccinimide ester,bmps,3-maleimidopropionic acid n-succinimidyl ester,3-maleimidopropionic acid nhs,succinimido 3-maleimidopropanoate,2,5-dioxopyrrolidin-1-yl 3-2,5-dioxopyrrol-1-yl propanoate,3-maleimidopropionic acid n-hydroxysuccinimide ester PubChem CID: 4620597 IUPAC Name: (2,5-dioxopyrrolidin-1-yl) 3-(2,5-dioxopyrrol-1-yl)propanoate SMILES: C1CC(=O)N(C1=O)OC(=O)CCN2C(=O)C=CC2=O
| PubChem CID | 4620597 |
|---|---|
| CAS | 55750-62-4 |
| Molecular Weight (g/mol) | 266.209 |
| MDL Number | MFCD00043141 |
| SMILES | C1CC(=O)N(C1=O)OC(=O)CCN2C(=O)C=CC2=O |
| Synonym | n-succinimidyl 3-maleimidopropionate,2,5-dioxopyrrolidin-1-yl 3-2,5-dioxo-2,5-dihydro-1h-pyrrol-1-yl propanoate,3-maleimido propionic acid n-hydroxysuccinimide ester,bmps,3-maleimidopropionic acid n-succinimidyl ester,3-maleimidopropionic acid nhs,succinimido 3-maleimidopropanoate,2,5-dioxopyrrolidin-1-yl 3-2,5-dioxopyrrol-1-yl propanoate,3-maleimidopropionic acid n-hydroxysuccinimide ester |
| IUPAC Name | (2,5-dioxopyrrolidin-1-yl) 3-(2,5-dioxopyrrol-1-yl)propanoate |
| InChI Key | JKHVDAUOODACDU-UHFFFAOYSA-N |
| Molecular Formula | C11H10N2O6 |
Sesamol 98.0+%, TCI America™
CAS: 533-31-3 Molecular Formula: C7H6O3 Molecular Weight (g/mol): 138.122 MDL Number: MFCD00005827 InChI Key: LUSZGTFNYDARNI-UHFFFAOYSA-N Synonym: sesamol,3,4-methylenedioxy phenol,5-hydroxy-1,3-benzodioxole,3,4-methylenedioxyphenol,2h-1,3-benzodioxol-5-ol,3,4-methylendioxyphenol,methylene ether of oxyhydroquinone,phenol, 3,4-methylenedioxy,5-benzodioxolol,unii-94iea0nv89 PubChem CID: 68289 ChEBI: CHEBI:9126 IUPAC Name: 1,3-benzodioxol-5-ol SMILES: C1OC2=C(O1)C=C(C=C2)O
| PubChem CID | 68289 |
|---|---|
| CAS | 533-31-3 |
| Molecular Weight (g/mol) | 138.122 |
| ChEBI | CHEBI:9126 |
| MDL Number | MFCD00005827 |
| SMILES | C1OC2=C(O1)C=C(C=C2)O |
| Synonym | sesamol,3,4-methylenedioxy phenol,5-hydroxy-1,3-benzodioxole,3,4-methylenedioxyphenol,2h-1,3-benzodioxol-5-ol,3,4-methylendioxyphenol,methylene ether of oxyhydroquinone,phenol, 3,4-methylenedioxy,5-benzodioxolol,unii-94iea0nv89 |
| IUPAC Name | 1,3-benzodioxol-5-ol |
| InChI Key | LUSZGTFNYDARNI-UHFFFAOYSA-N |
| Molecular Formula | C7H6O3 |
N-Succinimidyl S-Acetylthioglycolate 94.0+%, TCI America™
CAS: 76931-93-6 Molecular Formula: C8H9NO5S Molecular Weight (g/mol): 231.222 MDL Number: MFCD00036891 InChI Key: FLCQLSRLQIPNLM-UHFFFAOYSA-N Synonym: sata,n-succinimidyl-s-acetylthioacetate,2,5-dioxopyrrolidin-1-yl 2-acetylthio acetate,n-succinimidyl s-acetylthioglycolate,n-hydroxysuccinimide s-acetylthioacetate,2,5-dioxopyrrolidin-1-yl 2-acetylsulfanylacetate,s-acetylthioglycolic acid n-hydroxysuccinimide ester,hsata,n-succinimidyl s-acetylthioacetate,ethanethioic acid, s-2-2,5-dioxo-1-pyrrolidinyl oxy-2-oxoethyl ester PubChem CID: 127532 IUPAC Name: (2,5-dioxopyrrolidin-1-yl) 2-acetylsulfanylacetate SMILES: CC(=O)SCC(=O)ON1C(=O)CCC1=O
| PubChem CID | 127532 |
|---|---|
| CAS | 76931-93-6 |
| Molecular Weight (g/mol) | 231.222 |
| MDL Number | MFCD00036891 |
| SMILES | CC(=O)SCC(=O)ON1C(=O)CCC1=O |
| Synonym | sata,n-succinimidyl-s-acetylthioacetate,2,5-dioxopyrrolidin-1-yl 2-acetylthio acetate,n-succinimidyl s-acetylthioglycolate,n-hydroxysuccinimide s-acetylthioacetate,2,5-dioxopyrrolidin-1-yl 2-acetylsulfanylacetate,s-acetylthioglycolic acid n-hydroxysuccinimide ester,hsata,n-succinimidyl s-acetylthioacetate,ethanethioic acid, s-2-2,5-dioxo-1-pyrrolidinyl oxy-2-oxoethyl ester |
| IUPAC Name | (2,5-dioxopyrrolidin-1-yl) 2-acetylsulfanylacetate |
| InChI Key | FLCQLSRLQIPNLM-UHFFFAOYSA-N |
| Molecular Formula | C8H9NO5S |
Phenylthiohydantoin-methionine 98.0+%, TCI America™
CAS: 4370-90-5 Molecular Formula: C12H14N2OS2 Molecular Weight (g/mol): 266.377 MDL Number: MFCD06858379 InChI Key: KALSXWPXUWRLOH-UHFFFAOYSA-N Synonym: 5-[2-(Methylthio)ethyl]-3-phenyl-2-thiohydantoin, PTH-methionine PubChem CID: 2872023 IUPAC Name: 5-(2-methylsulfanylethyl)-3-phenyl-2-sulfanylideneimidazolidin-4-one SMILES: CSCCC1C(=O)N(C(=S)N1)C2=CC=CC=C2
| PubChem CID | 2872023 |
|---|---|
| CAS | 4370-90-5 |
| Molecular Weight (g/mol) | 266.377 |
| MDL Number | MFCD06858379 |
| SMILES | CSCCC1C(=O)N(C(=S)N1)C2=CC=CC=C2 |
| Synonym | 5-[2-(Methylthio)ethyl]-3-phenyl-2-thiohydantoin, PTH-methionine |
| IUPAC Name | 5-(2-methylsulfanylethyl)-3-phenyl-2-sulfanylideneimidazolidin-4-one |
| InChI Key | KALSXWPXUWRLOH-UHFFFAOYSA-N |
| Molecular Formula | C12H14N2OS2 |
Phenylthiohydantoin-phenylalanine, TCI America™
CAS: 4332-97-2 Molecular Formula: C16H14N2OS Molecular Weight (g/mol): 282.361 MDL Number: MFCD01076623 InChI Key: HIDCDSHFIITFOM-UHFFFAOYSA-N Synonym: 5-Benzyl-3-phenyl-2-thiohydantoin, PTH-phenylalanine PubChem CID: 2871911 IUPAC Name: 5-benzyl-3-phenyl-2-sulfanylideneimidazolidin-4-one SMILES: C1=CC=C(C=C1)CC2C(=O)N(C(=S)N2)C3=CC=CC=C3
| PubChem CID | 2871911 |
|---|---|
| CAS | 4332-97-2 |
| Molecular Weight (g/mol) | 282.361 |
| MDL Number | MFCD01076623 |
| SMILES | C1=CC=C(C=C1)CC2C(=O)N(C(=S)N2)C3=CC=CC=C3 |
| Synonym | 5-Benzyl-3-phenyl-2-thiohydantoin, PTH-phenylalanine |
| IUPAC Name | 5-benzyl-3-phenyl-2-sulfanylideneimidazolidin-4-one |
| InChI Key | HIDCDSHFIITFOM-UHFFFAOYSA-N |
| Molecular Formula | C16H14N2OS |
Pyridoxal Hydrochloride 98.0+%, TCI America™
CAS: 65-22-5 Molecular Formula: C8H10ClNO3 Molecular Weight (g/mol): 203.622 MDL Number: MFCD00012809 InChI Key: FCHXJFJNDJXENQ-UHFFFAOYSA-N Synonym: pyridoxal hydrochloride,pyridoxal hcl,vitamin b6 hydrochloride,3-hydroxy-5-hydroxymethyl-2-methylisonicotinaldehyde hydrochloride,unii-1416kf0qbc,2-methyl-3-hydroxy-4-formyl-5-hydroxymethylpyridine hydrochloride,pl hcl,3-hydroxy-5-hydroxymethyl-2-methylisonicotinaldehyde, hydrochloride,3-hydroxy-5-hydroxymethyl-2-methyl-4-pyridinecarboxaldehyde hydrochloride,3-hydroxy-5-hydroxymethyl-2-methylpyridine-4-carbaldehyde hydrochloride PubChem CID: 6171 IUPAC Name: 3-hydroxy-5-(hydroxymethyl)-2-methylpyridine-4-carbaldehyde;hydrochloride SMILES: CC1=NC=C(C(=C1O)C=O)CO.Cl
| PubChem CID | 6171 |
|---|---|
| CAS | 65-22-5 |
| Molecular Weight (g/mol) | 203.622 |
| MDL Number | MFCD00012809 |
| SMILES | CC1=NC=C(C(=C1O)C=O)CO.Cl |
| Synonym | pyridoxal hydrochloride,pyridoxal hcl,vitamin b6 hydrochloride,3-hydroxy-5-hydroxymethyl-2-methylisonicotinaldehyde hydrochloride,unii-1416kf0qbc,2-methyl-3-hydroxy-4-formyl-5-hydroxymethylpyridine hydrochloride,pl hcl,3-hydroxy-5-hydroxymethyl-2-methylisonicotinaldehyde, hydrochloride,3-hydroxy-5-hydroxymethyl-2-methyl-4-pyridinecarboxaldehyde hydrochloride,3-hydroxy-5-hydroxymethyl-2-methylpyridine-4-carbaldehyde hydrochloride |
| IUPAC Name | 3-hydroxy-5-(hydroxymethyl)-2-methylpyridine-4-carbaldehyde;hydrochloride |
| InChI Key | FCHXJFJNDJXENQ-UHFFFAOYSA-N |
| Molecular Formula | C8H10ClNO3 |
Piperonyl Alcohol 98.0+%, TCI America™
CAS: 495-76-1 Molecular Formula: C8H8O3 Molecular Weight (g/mol): 152.149 MDL Number: MFCD00005836 InChI Key: BHUIUXNAPJIDOG-UHFFFAOYSA-N Synonym: piperonyl alcohol,piperonol,1,3-benzodioxole-5-methanol,3,4-methylenedioxybenzyl alcohol,benzo d 1,3 dioxol-5-ylmethanol,piperonylalcohol,5-hydroxymethyl-1,3-benzodioxole,1-hydroxymethyl-3,4-methylenedioxybenzene,benzo 1,3 dioxol-5-ylmethanol,3,4-methylenedioxy phenylmethanol PubChem CID: 10322 IUPAC Name: 1,3-benzodioxol-5-ylmethanol SMILES: C1OC2=C(O1)C=C(C=C2)CO
| PubChem CID | 10322 |
|---|---|
| CAS | 495-76-1 |
| Molecular Weight (g/mol) | 152.149 |
| MDL Number | MFCD00005836 |
| SMILES | C1OC2=C(O1)C=C(C=C2)CO |
| Synonym | piperonyl alcohol,piperonol,1,3-benzodioxole-5-methanol,3,4-methylenedioxybenzyl alcohol,benzo d 1,3 dioxol-5-ylmethanol,piperonylalcohol,5-hydroxymethyl-1,3-benzodioxole,1-hydroxymethyl-3,4-methylenedioxybenzene,benzo 1,3 dioxol-5-ylmethanol,3,4-methylenedioxy phenylmethanol |
| IUPAC Name | 1,3-benzodioxol-5-ylmethanol |
| InChI Key | BHUIUXNAPJIDOG-UHFFFAOYSA-N |
| Molecular Formula | C8H8O3 |
Pyrazole 98.0+%, TCI America™
CAS: 288-13-1 Molecular Formula: C3H4N2 Molecular Weight (g/mol): 68.079 MDL Number: MFCD00005234 InChI Key: WTKZEGDFNFYCGP-UHFFFAOYSA-N Synonym: pyrazole,1,2-diazole,1h-pyrazol,pyrazol,unii-3qd5kjz7zj,3qd5kjz7zj,diazole,hpz,1-h-pyrazole,pyrazol#1 PubChem CID: 1048 ChEBI: CHEBI:17241 IUPAC Name: 1H-pyrazole SMILES: C1=CNN=C1
| PubChem CID | 1048 |
|---|---|
| CAS | 288-13-1 |
| Molecular Weight (g/mol) | 68.079 |
| ChEBI | CHEBI:17241 |
| MDL Number | MFCD00005234 |
| SMILES | C1=CNN=C1 |
| Synonym | pyrazole,1,2-diazole,1h-pyrazol,pyrazol,unii-3qd5kjz7zj,3qd5kjz7zj,diazole,hpz,1-h-pyrazole,pyrazol#1 |
| IUPAC Name | 1H-pyrazole |
| InChI Key | WTKZEGDFNFYCGP-UHFFFAOYSA-N |
| Molecular Formula | C3H4N2 |
8-Hydroxy-7-propylquinoline 98.0+%, TCI America™
CAS: 58327-60-9 Molecular Formula: C12H13NO Molecular Weight (g/mol): 187.242 MDL Number: MFCD00059755 InChI Key: OKPSVYHYNXVYED-UHFFFAOYSA-N Synonym: 7-Propyloxine, 7-Propyl-8-quinolinol PubChem CID: 11604513 IUPAC Name: 7-propylquinolin-8-ol SMILES: CCCC1=C(C2=C(C=CC=N2)C=C1)O
| PubChem CID | 11604513 |
|---|---|
| CAS | 58327-60-9 |
| Molecular Weight (g/mol) | 187.242 |
| MDL Number | MFCD00059755 |
| SMILES | CCCC1=C(C2=C(C=CC=N2)C=C1)O |
| Synonym | 7-Propyloxine, 7-Propyl-8-quinolinol |
| IUPAC Name | 7-propylquinolin-8-ol |
| InChI Key | OKPSVYHYNXVYED-UHFFFAOYSA-N |
| Molecular Formula | C12H13NO |
1,10-Phenanthroline Monohydrate 98.0+%, TCI America™
CAS: 5144-89-8 Molecular Formula: C12H10N2O Molecular Weight (g/mol): 198.23 MDL Number: MFCD00149973 InChI Key: PPQJCISYYXZCAE-UHFFFAOYSA-N Synonym: 1,10-phenanthroline hydrate,1,10-phenanthroline monohydrate,o-phenanthroline monohydrate,unii-ksx215x00e,1,10-fenantrolina,4,5-phenanthroline monohydrate,1,10-phenanthroline, monohydrate,1,10-fenanthrolin,1,10-phenanthrolineo-phenanthroline,1, 10-phenanthroline monohydrate PubChem CID: 21226 IUPAC Name: 1,10-phenanthroline hydrate SMILES: O.C1=CN=C2C(C=CC3=CC=CN=C23)=C1
| PubChem CID | 21226 |
|---|---|
| CAS | 5144-89-8 |
| Molecular Weight (g/mol) | 198.23 |
| MDL Number | MFCD00149973 |
| SMILES | O.C1=CN=C2C(C=CC3=CC=CN=C23)=C1 |
| Synonym | 1,10-phenanthroline hydrate,1,10-phenanthroline monohydrate,o-phenanthroline monohydrate,unii-ksx215x00e,1,10-fenantrolina,4,5-phenanthroline monohydrate,1,10-phenanthroline, monohydrate,1,10-fenanthrolin,1,10-phenanthrolineo-phenanthroline,1, 10-phenanthroline monohydrate |
| IUPAC Name | 1,10-phenanthroline hydrate |
| InChI Key | PPQJCISYYXZCAE-UHFFFAOYSA-N |
| Molecular Formula | C12H10N2O |
1,1'-[1,4-Phenylenebis(methylene)]bis(4,4'-bipyridinium) Dibromide 98.0+%, TCI America™
CAS: 106867-97-4 Molecular Formula: C28H24Br2N4 Molecular Weight (g/mol): 576.34 MDL Number: MFCD03844804 InChI Key: QSNYIUIZTNLTGX-UHFFFAOYSA-L Synonym: 1,1′C-(p-Xylylene)bis(4,4′C-bipyridinium) Dibromide PubChem CID: 44630455 IUPAC Name: 1-{[4-({[4,4'-bipyridin]-1-ium-1-yl}methyl)phenyl]methyl}-[4,4'-bipyridin]-1-ium dibromide SMILES: [Br-].[Br-].C(C1=CC=C(C[N+]2=CC=C(C=C2)C2=CC=NC=C2)C=C1)[N+]1=CC=C(C=C1)C1=CC=NC=C1
| PubChem CID | 44630455 |
|---|---|
| CAS | 106867-97-4 |
| Molecular Weight (g/mol) | 576.34 |
| MDL Number | MFCD03844804 |
| SMILES | [Br-].[Br-].C(C1=CC=C(C[N+]2=CC=C(C=C2)C2=CC=NC=C2)C=C1)[N+]1=CC=C(C=C1)C1=CC=NC=C1 |
| Synonym | 1,1′C-(p-Xylylene)bis(4,4′C-bipyridinium) Dibromide |
| IUPAC Name | 1-{[4-({[4,4'-bipyridin]-1-ium-1-yl}methyl)phenyl]methyl}-[4,4'-bipyridin]-1-ium dibromide |
| InChI Key | QSNYIUIZTNLTGX-UHFFFAOYSA-L |
| Molecular Formula | C28H24Br2N4 |
Pizotifen 98.0+%, TCI America™
CAS: 15574-96-6 Molecular Formula: C19H21NS Molecular Weight (g/mol): 295.444 MDL Number: MFCD00864192 InChI Key: FIADGNVRKBPQEU-UHFFFAOYSA-N Synonym: 4-[9,10-Dihydro-4H-benzo[4,5]cyclohepta[1,2-b]thien-4-ylidene]-1-methylpiperidine, Sandomigran PubChem CID: 27400 ChEBI: CHEBI:50212 IUPAC Name: 4-(4,5-dihydrobenzo[1,2]cyclohepta[3,4-b]thiophen-10-ylidene)-1-methylpiperidine SMILES: CN1CCC(=C2C3=C(CCC4=CC=CC=C42)SC=C3)CC1
| PubChem CID | 27400 |
|---|---|
| CAS | 15574-96-6 |
| Molecular Weight (g/mol) | 295.444 |
| ChEBI | CHEBI:50212 |
| MDL Number | MFCD00864192 |
| SMILES | CN1CCC(=C2C3=C(CCC4=CC=CC=C42)SC=C3)CC1 |
| Synonym | 4-[9,10-Dihydro-4H-benzo[4,5]cyclohepta[1,2-b]thien-4-ylidene]-1-methylpiperidine, Sandomigran |
| IUPAC Name | 4-(4,5-dihydrobenzo[1,2]cyclohepta[3,4-b]thiophen-10-ylidene)-1-methylpiperidine |
| InChI Key | FIADGNVRKBPQEU-UHFFFAOYSA-N |
| Molecular Formula | C19H21NS |
4-(3-Phenylpropyl)pyridine 98.0+%, TCI America™
CAS: 2057-49-0 Molecular Formula: C14H15N Molecular Weight (g/mol): 197.281 MDL Number: MFCD00047458 InChI Key: AQIIVEISJBBUCR-UHFFFAOYSA-N Synonym: 4-3-phenylpropyl pyridine,pyridine, 4-3-phenylpropyl,1-phenyl-3-4-pyridyl propane,unii-yw9q68ek6b,4-phenylpropylpyridine,yw9q68ek6b,1-4-pyridyl-3-phenylpropane,acmc-1ccts,dsstox_cid_24869,dsstox_rid_80544 PubChem CID: 74937 IUPAC Name: 4-(3-phenylpropyl)pyridine SMILES: C1=CC=C(C=C1)CCCC2=CC=NC=C2
| PubChem CID | 74937 |
|---|---|
| CAS | 2057-49-0 |
| Molecular Weight (g/mol) | 197.281 |
| MDL Number | MFCD00047458 |
| SMILES | C1=CC=C(C=C1)CCCC2=CC=NC=C2 |
| Synonym | 4-3-phenylpropyl pyridine,pyridine, 4-3-phenylpropyl,1-phenyl-3-4-pyridyl propane,unii-yw9q68ek6b,4-phenylpropylpyridine,yw9q68ek6b,1-4-pyridyl-3-phenylpropane,acmc-1ccts,dsstox_cid_24869,dsstox_rid_80544 |
| IUPAC Name | 4-(3-phenylpropyl)pyridine |
| InChI Key | AQIIVEISJBBUCR-UHFFFAOYSA-N |
| Molecular Formula | C14H15N |