Organoheterocyclic compounds
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Thermo Scientific Chemicals Phenolphthalein, 98%
CAS: 77-09-8 Molecular Formula: C20H14O4 Molecular Weight (g/mol): 318.33 MDL Number: MFCD00005913 InChI Key: KJFMBFZCATUALV-UHFFFAOYSA-N Synonym: phenolphthalein,phthalimetten,euchessina,phthalin,espotabs,phenolax,purgophen,koprol,laxogen,trilax PubChem CID: 4764 ChEBI: CHEBI:34914 SMILES: OC1=CC=C(C=C1)C1(OC(=O)C2=CC=CC=C12)C1=CC=C(O)C=C1
| PubChem CID | 4764 |
|---|---|
| CAS | 77-09-8 |
| Molecular Weight (g/mol) | 318.33 |
| ChEBI | CHEBI:34914 |
| MDL Number | MFCD00005913 |
| SMILES | OC1=CC=C(C=C1)C1(OC(=O)C2=CC=CC=C12)C1=CC=C(O)C=C1 |
| Synonym | phenolphthalein,phthalimetten,euchessina,phthalin,espotabs,phenolax,purgophen,koprol,laxogen,trilax |
| InChI Key | KJFMBFZCATUALV-UHFFFAOYSA-N |
| Molecular Formula | C20H14O4 |
2-Mercaptopyridine, 98%
CAS: 2637-34-5 Molecular Formula: C5H5NS Molecular Weight (g/mol): 111.16 MDL Number: MFCD00006285 InChI Key: WHMDPDGBKYUEMW-UHFFFAOYSA-N Synonym: 2-mercaptopyridine,2-pyridinethiol,pyridine-2-thiol,2-thiopyridine,pyrid-2-thione,2 1h-pyridinethione,pyridinethione,2-thiopyridone,2-pyridinethione,2-mercapto pyridine PubChem CID: 2723698 ChEBI: CHEBI:45223 IUPAC Name: 1H-pyridine-2-thione SMILES: C1=CC(=S)NC=C1
| PubChem CID | 2723698 |
|---|---|
| CAS | 2637-34-5 |
| Molecular Weight (g/mol) | 111.16 |
| ChEBI | CHEBI:45223 |
| MDL Number | MFCD00006285 |
| SMILES | C1=CC(=S)NC=C1 |
| Synonym | 2-mercaptopyridine,2-pyridinethiol,pyridine-2-thiol,2-thiopyridine,pyrid-2-thione,2 1h-pyridinethione,pyridinethione,2-thiopyridone,2-pyridinethione,2-mercapto pyridine |
| IUPAC Name | 1H-pyridine-2-thione |
| InChI Key | WHMDPDGBKYUEMW-UHFFFAOYSA-N |
| Molecular Formula | C5H5NS |
1,10-Phenanthroline, 99%, may contain up to 1.5% water
CAS: 66-71-7 Molecular Formula: C12H8N2 Molecular Weight (g/mol): 180.21 MDL Number: MFCD00011678 InChI Key: DGEZNRSVGBDHLK-UHFFFAOYSA-N Synonym: o-phenanthroline,4,5-diazaphenanthrene,orthophenanthroline,phenanthroline,1,10-o-phenanthroline,phen,2-phenanthroline,beta-phenanthroline,.beta.-phenanthroline PubChem CID: 1318 ChEBI: CHEBI:44975 IUPAC Name: 1,10-phenanthroline SMILES: C1=CC2=C(C3=C(C=CC=N3)C=C2)N=C1
| PubChem CID | 1318 |
|---|---|
| CAS | 66-71-7 |
| Molecular Weight (g/mol) | 180.21 |
| ChEBI | CHEBI:44975 |
| MDL Number | MFCD00011678 |
| SMILES | C1=CC2=C(C3=C(C=CC=N3)C=C2)N=C1 |
| Synonym | o-phenanthroline,4,5-diazaphenanthrene,orthophenanthroline,phenanthroline,1,10-o-phenanthroline,phen,2-phenanthroline,beta-phenanthroline,.beta.-phenanthroline |
| IUPAC Name | 1,10-phenanthroline |
| InChI Key | DGEZNRSVGBDHLK-UHFFFAOYSA-N |
| Molecular Formula | C12H8N2 |
3-Sulfolene 98.0+%, TCI America™
CAS: 77-79-2 Molecular Formula: C4H6O2S Molecular Weight (g/mol): 118.15 MDL Number: MFCD00005481 InChI Key: MBDNRNMVTZADMQ-UHFFFAOYSA-N Synonym: 3-sulfolene,butadiene sulfone,sulfolene,thiophene, 2,5-dihydro-, 1,1-dioxide,beta-sulfolene,2,5-dihydrothiophene sulfone,2,5-dihydrothiophene dioxide,2,5-dihydrothiophene-1,1-dioxide,sulfol-3-ene,ccris 569 PubChem CID: 6498 IUPAC Name: 2,5-dihydrothiophene 1,1-dioxide SMILES: C1C=CCS1(=O)=O
| PubChem CID | 6498 |
|---|---|
| CAS | 77-79-2 |
| Molecular Weight (g/mol) | 118.15 |
| MDL Number | MFCD00005481 |
| SMILES | C1C=CCS1(=O)=O |
| Synonym | 3-sulfolene,butadiene sulfone,sulfolene,thiophene, 2,5-dihydro-, 1,1-dioxide,beta-sulfolene,2,5-dihydrothiophene sulfone,2,5-dihydrothiophene dioxide,2,5-dihydrothiophene-1,1-dioxide,sulfol-3-ene,ccris 569 |
| IUPAC Name | 2,5-dihydrothiophene 1,1-dioxide |
| InChI Key | MBDNRNMVTZADMQ-UHFFFAOYSA-N |
| Molecular Formula | C4H6O2S |
Tris(1,10-phenanthroline)iron(II) sulfate, 0.025M aqueous solution
CAS: 14634-91-4 Molecular Formula: C36H24FeN6O4S Molecular Weight (g/mol): 692.53 MDL Number: MFCD00036428 InChI Key: CIWXFRVOSDNDJZ-UHFFFAOYSA-L Synonym: ferroin,ferroin indicator solution,iron 2+ , tris 1,10-phenanthroline-.kappa.n1,.kappa.n10-, oc-6-11-, sulfate 1:1,ferroin sulfate,ferroin solution,1,10-phenanthroline ferrous sulfate,tris 1,10-phenanthroline-n1,n10 iron sulphate,ferrous 1,10-phenanthroline sulfate,ferroin indicator solution, 25 mmol/l,iron 2+ , tris 1,10-phenanthroline-kappan1,kappan10-, oc-6-11-, sulfate 1:1 PubChem CID: 84567 IUPAC Name: iron(2+);1,10-phenanthroline;sulfate SMILES: [Fe++].[O-]S([O-])(=O)=O.C1=CN=C2C(C=CC3=CC=CN=C23)=C1.C1=CN=C2C(C=CC3=CC=CN=C23)=C1.C1=CN=C2C(C=CC3=CC=CN=C23)=C1
| PubChem CID | 84567 |
|---|---|
| CAS | 14634-91-4 |
| Molecular Weight (g/mol) | 692.53 |
| MDL Number | MFCD00036428 |
| SMILES | [Fe++].[O-]S([O-])(=O)=O.C1=CN=C2C(C=CC3=CC=CN=C23)=C1.C1=CN=C2C(C=CC3=CC=CN=C23)=C1.C1=CN=C2C(C=CC3=CC=CN=C23)=C1 |
| Synonym | ferroin,ferroin indicator solution,iron 2+ , tris 1,10-phenanthroline-.kappa.n1,.kappa.n10-, oc-6-11-, sulfate 1:1,ferroin sulfate,ferroin solution,1,10-phenanthroline ferrous sulfate,tris 1,10-phenanthroline-n1,n10 iron sulphate,ferrous 1,10-phenanthroline sulfate,ferroin indicator solution, 25 mmol/l,iron 2+ , tris 1,10-phenanthroline-kappan1,kappan10-, oc-6-11-, sulfate 1:1 |
| IUPAC Name | iron(2+);1,10-phenanthroline;sulfate |
| InChI Key | CIWXFRVOSDNDJZ-UHFFFAOYSA-L |
| Molecular Formula | C36H24FeN6O4S |
Ethidium bromide, 95%
CAS: 1239-45-8 Molecular Formula: C21H20BrN3 Molecular Weight (g/mol): 394.32 MDL Number: MFCD00011724 InChI Key: ZMMJGEGLRURXTF-UHFFFAOYSA-N Synonym: ethidium bromide,homidium bromide,dromilac,3,8-diamino-5-ethyl-6-phenylphenanthridinium bromide,ethydium bromide,3,8-diamino-5-ethyl-6-phenylphenanthridin-5-ium bromide,etbr,2,7-diamino-10-ethyl-9-phenylphenanthridinium bromide,2,7-diamino-9-phenyl-10-ethylphenanthridinium bromide,unii-059nuo2z1l PubChem CID: 14710 ChEBI: CHEBI:4883 SMILES: [Br-].CC[N+]1=C(C2=CC=CC=C2)C2=CC(N)=CC=C2C2=CC=C(N)C=C12
| PubChem CID | 14710 |
|---|---|
| CAS | 1239-45-8 |
| Molecular Weight (g/mol) | 394.32 |
| ChEBI | CHEBI:4883 |
| MDL Number | MFCD00011724 |
| SMILES | [Br-].CC[N+]1=C(C2=CC=CC=C2)C2=CC(N)=CC=C2C2=CC=C(N)C=C12 |
| Synonym | ethidium bromide,homidium bromide,dromilac,3,8-diamino-5-ethyl-6-phenylphenanthridinium bromide,ethydium bromide,3,8-diamino-5-ethyl-6-phenylphenanthridin-5-ium bromide,etbr,2,7-diamino-10-ethyl-9-phenylphenanthridinium bromide,2,7-diamino-9-phenyl-10-ethylphenanthridinium bromide,unii-059nuo2z1l |
| InChI Key | ZMMJGEGLRURXTF-UHFFFAOYSA-N |
| Molecular Formula | C21H20BrN3 |
Azobenzene, 97+%
CAS: 103-33-3 Molecular Formula: C12H10N2 Molecular Weight (g/mol): 182.23 MDL Number: MFCD00003022 InChI Key: DMLAVOWQYNRWNQ-UHFFFAOYSA-N Synonym: azobenzene,diazene, diphenyl,diazobenzene,e-diphenyldiazene,azobisbenzene,azofume,1,2-diphenyldiazene,azodibenzeneazofume,diphenyldiimide,azobenzide PubChem CID: 2272 ChEBI: CHEBI:190358 IUPAC Name: diphenyldiazene SMILES: C1=CC=C(C=C1)N=NC1=CC=CC=C1
| PubChem CID | 2272 |
|---|---|
| CAS | 103-33-3 |
| Molecular Weight (g/mol) | 182.23 |
| ChEBI | CHEBI:190358 |
| MDL Number | MFCD00003022 |
| SMILES | C1=CC=C(C=C1)N=NC1=CC=CC=C1 |
| Synonym | azobenzene,diazene, diphenyl,diazobenzene,e-diphenyldiazene,azobisbenzene,azofume,1,2-diphenyldiazene,azodibenzeneazofume,diphenyldiimide,azobenzide |
| IUPAC Name | diphenyldiazene |
| InChI Key | DMLAVOWQYNRWNQ-UHFFFAOYSA-N |
| Molecular Formula | C12H10N2 |
3-Hydroxy-5-methylisoxazole 98.0+%, TCI America™
CAS: 10004-44-1 Molecular Formula: C4H5NO2 Molecular Weight (g/mol): 99.089 MDL Number: MFCD00144468 InChI Key: KGVPNLBXJKTABS-UHFFFAOYSA-N Synonym: hymexazol,3-hydroxy-5-methylisoxazole,hymexazole,5-methylisoxazol-3-ol,5-methylisoxazol-3 2h-one,hydroxyisoxazole,tachigaren,itachigarden,5-methyl-3-hydroxyisoxazole,5-methyl-3 2h-isoxazolone PubChem CID: 24781 ChEBI: CHEBI:5827 IUPAC Name: 5-methyl-1,2-oxazol-3-one SMILES: CC1=CC(=O)NO1
| PubChem CID | 24781 |
|---|---|
| CAS | 10004-44-1 |
| Molecular Weight (g/mol) | 99.089 |
| ChEBI | CHEBI:5827 |
| MDL Number | MFCD00144468 |
| SMILES | CC1=CC(=O)NO1 |
| Synonym | hymexazol,3-hydroxy-5-methylisoxazole,hymexazole,5-methylisoxazol-3-ol,5-methylisoxazol-3 2h-one,hydroxyisoxazole,tachigaren,itachigarden,5-methyl-3-hydroxyisoxazole,5-methyl-3 2h-isoxazolone |
| IUPAC Name | 5-methyl-1,2-oxazol-3-one |
| InChI Key | KGVPNLBXJKTABS-UHFFFAOYSA-N |
| Molecular Formula | C4H5NO2 |
Lovastatin, 97%
CAS: 75330-75-5 Molecular Formula: C24H36O5 Molecular Weight (g/mol): 404.55 MDL Number: MFCD00072164 InChI Key: PCZOHLXUXFIOCF-BXMDZJJMSA-N Synonym: lovastatin,mevinolin,mevacor,monacolin k,lovalip,altoprev,lovalord,mevinacor,nergadan,6alpha-methylcompactin PubChem CID: 53232 ChEBI: CHEBI:40303 IUPAC Name: (1S,3R,7S,8S,8aR)-8-{2-[(2R,4R)-4-hydroxy-6-oxooxan-2-yl]ethyl}-3,7-dimethyl-1,2,3,7,8,8a-hexahydronaphthalen-1-yl (2S)-2-methylbutanoate SMILES: CC[C@H](C)C(=O)O[C@H]1C[C@@H](C)C=C2C=C[C@H](C)[C@H](CC[C@@H]3C[C@@H](O)CC(=O)O3)[C@@H]12
| PubChem CID | 53232 |
|---|---|
| CAS | 75330-75-5 |
| Molecular Weight (g/mol) | 404.55 |
| ChEBI | CHEBI:40303 |
| MDL Number | MFCD00072164 |
| SMILES | CC[C@H](C)C(=O)O[C@H]1C[C@@H](C)C=C2C=C[C@H](C)[C@H](CC[C@@H]3C[C@@H](O)CC(=O)O3)[C@@H]12 |
| Synonym | lovastatin,mevinolin,mevacor,monacolin k,lovalip,altoprev,lovalord,mevinacor,nergadan,6alpha-methylcompactin |
| IUPAC Name | (1S,3R,7S,8S,8aR)-8-{2-[(2R,4R)-4-hydroxy-6-oxooxan-2-yl]ethyl}-3,7-dimethyl-1,2,3,7,8,8a-hexahydronaphthalen-1-yl (2S)-2-methylbutanoate |
| InChI Key | PCZOHLXUXFIOCF-BXMDZJJMSA-N |
| Molecular Formula | C24H36O5 |
1-Boc-piperazine, 99%
CAS: 57260-71-6 Molecular Formula: C9H19N2O2 Molecular Weight (g/mol): 187.26 MDL Number: MFCD00075265 InChI Key: CWXPZXBSDSIRCS-UHFFFAOYSA-O Synonym: 1-boc-piperazine,n-boc-piperazine,1-n-boc-piperazine,tert-butyl 1-piperazinecarboxylate,1-tert-butoxycarbonyl piperazine,n-t-butoxycarbonylpiperazine,boc-piperazine,n-tert-butoxycarbonylpiperazine,piperazine-1-carboxylic acid tert-butyl ester,1-piperazinecarboxylic acid, 1,1-dimethylethyl ester PubChem CID: 143452 IUPAC Name: tert-butyl piperazine-1-carboxylate SMILES: CC(C)(C)OC(=O)N1CC[NH2+]CC1
| PubChem CID | 143452 |
|---|---|
| CAS | 57260-71-6 |
| Molecular Weight (g/mol) | 187.26 |
| MDL Number | MFCD00075265 |
| SMILES | CC(C)(C)OC(=O)N1CC[NH2+]CC1 |
| Synonym | 1-boc-piperazine,n-boc-piperazine,1-n-boc-piperazine,tert-butyl 1-piperazinecarboxylate,1-tert-butoxycarbonyl piperazine,n-t-butoxycarbonylpiperazine,boc-piperazine,n-tert-butoxycarbonylpiperazine,piperazine-1-carboxylic acid tert-butyl ester,1-piperazinecarboxylic acid, 1,1-dimethylethyl ester |
| IUPAC Name | tert-butyl piperazine-1-carboxylate |
| InChI Key | CWXPZXBSDSIRCS-UHFFFAOYSA-O |
| Molecular Formula | C9H19N2O2 |
Quinoline, 96%
CAS: 91-22-5 Molecular Formula: C9H7N Molecular Weight (g/mol): 129.16 MDL Number: MFCD00006736,MFCD06637409,MFCD31699982,MFCD31699983,MFCD31699984,MFCD31699985,MFCD31699986,MFCD31699987 InChI Key: SMWDFEZZVXVKRB-UHFFFAOYSA-N Synonym: chinolin,chinoline,1-benzazine,quinolin,1-azanaphthalene,chinoleine,leucol,benzo b pyridine,benzopyridine,leukol PubChem CID: 7047 ChEBI: CHEBI:17362 IUPAC Name: quinoline SMILES: C1=CC=C2N=CC=CC2=C1
| PubChem CID | 7047 |
|---|---|
| CAS | 91-22-5 |
| Molecular Weight (g/mol) | 129.16 |
| ChEBI | CHEBI:17362 |
| MDL Number | MFCD00006736,MFCD06637409,MFCD31699982,MFCD31699983,MFCD31699984,MFCD31699985,MFCD31699986,MFCD31699987 |
| SMILES | C1=CC=C2N=CC=CC2=C1 |
| Synonym | chinolin,chinoline,1-benzazine,quinolin,1-azanaphthalene,chinoleine,leucol,benzo b pyridine,benzopyridine,leukol |
| IUPAC Name | quinoline |
| InChI Key | SMWDFEZZVXVKRB-UHFFFAOYSA-N |
| Molecular Formula | C9H7N |
2-Pyrrolidinone, 99%
CAS: 616-45-5 Molecular Formula: C4H7NO Molecular Weight (g/mol): 85.11 MDL Number: MFCD00005270 InChI Key: HNJBEVLQSNELDL-UHFFFAOYSA-N Synonym: 2-pyrrolidinone,pyrrolidone,butyrolactam,2-pyrrolidone,2-oxopyrrolidine,pyrrolidon,2-ketopyrrolidine,2-pyrol,pyrrolidinone,gamma-butyrolactam PubChem CID: 12025 ChEBI: CHEBI:36592 IUPAC Name: pyrrolidin-2-one SMILES: C1CC(=O)NC1
| PubChem CID | 12025 |
|---|---|
| CAS | 616-45-5 |
| Molecular Weight (g/mol) | 85.11 |
| ChEBI | CHEBI:36592 |
| MDL Number | MFCD00005270 |
| SMILES | C1CC(=O)NC1 |
| Synonym | 2-pyrrolidinone,pyrrolidone,butyrolactam,2-pyrrolidone,2-oxopyrrolidine,pyrrolidon,2-ketopyrrolidine,2-pyrol,pyrrolidinone,gamma-butyrolactam |
| IUPAC Name | pyrrolidin-2-one |
| InChI Key | HNJBEVLQSNELDL-UHFFFAOYSA-N |
| Molecular Formula | C4H7NO |
4-Vinylpyridine, 95%, stab. with 80 to 150ppm hydroquinone
CAS: 100-43-6 Molecular Formula: C7H7N Molecular Weight (g/mol): 105.14 MDL Number: MFCD00006447 InChI Key: KFDVPJUYSDEJTH-UHFFFAOYSA-N Synonym: 4-vinylpyridine,pyridine, 4-ethenyl,pyridine, 4-vinyl,gamma-vinylpyridine,unii-i56g67xm8d,ccris 5240,4vp,4-pyridylethylene,4-vinyl-pyridine,4-vinyl pyridine PubChem CID: 7502 IUPAC Name: 4-ethenylpyridine SMILES: C=CC1=CC=NC=C1
| PubChem CID | 7502 |
|---|---|
| CAS | 100-43-6 |
| Molecular Weight (g/mol) | 105.14 |
| MDL Number | MFCD00006447 |
| SMILES | C=CC1=CC=NC=C1 |
| Synonym | 4-vinylpyridine,pyridine, 4-ethenyl,pyridine, 4-vinyl,gamma-vinylpyridine,unii-i56g67xm8d,ccris 5240,4vp,4-pyridylethylene,4-vinyl-pyridine,4-vinyl pyridine |
| IUPAC Name | 4-ethenylpyridine |
| InChI Key | KFDVPJUYSDEJTH-UHFFFAOYSA-N |
| Molecular Formula | C7H7N |
2-Phenylbenzimidazole-5-sulfonic acid, 98%
CAS: 27503-81-7 Molecular Formula: C13H10N2O3S Molecular Weight (g/mol): 274.29 MDL Number: MFCD00053007 InChI Key: UVCJGUGAGLDPAA-UHFFFAOYSA-N Synonym: ensulizole,2-phenylbenzimidazole-5-sulfonic acid,phenylbenzimidazole sulfonic acid,2-phenyl-1h-benzo d imidazole-5-sulfonic acid,2-phenyl-1h-benzo d imidazole-6-sulfonic acid,1h-benzimidazole-5-sulfonic acid, 2-phenyl,unii-9yq9di1w42,2-phenyl-1h-benzimidazole-5-sulfonic acid,parsol hs,2-phenyl-5-benzimidazolesulfonic acid PubChem CID: 33919 IUPAC Name: 2-phenyl-3H-benzimidazole-5-sulfonic acid SMILES: OS(=O)(=O)C1=CC=C2N=C(NC2=C1)C1=CC=CC=C1
| PubChem CID | 33919 |
|---|---|
| CAS | 27503-81-7 |
| Molecular Weight (g/mol) | 274.29 |
| MDL Number | MFCD00053007 |
| SMILES | OS(=O)(=O)C1=CC=C2N=C(NC2=C1)C1=CC=CC=C1 |
| Synonym | ensulizole,2-phenylbenzimidazole-5-sulfonic acid,phenylbenzimidazole sulfonic acid,2-phenyl-1h-benzo d imidazole-5-sulfonic acid,2-phenyl-1h-benzo d imidazole-6-sulfonic acid,1h-benzimidazole-5-sulfonic acid, 2-phenyl,unii-9yq9di1w42,2-phenyl-1h-benzimidazole-5-sulfonic acid,parsol hs,2-phenyl-5-benzimidazolesulfonic acid |
| IUPAC Name | 2-phenyl-3H-benzimidazole-5-sulfonic acid |
| InChI Key | UVCJGUGAGLDPAA-UHFFFAOYSA-N |
| Molecular Formula | C13H10N2O3S |
Epichlorohydrin 99.0+%, TCI America™
CAS: 106-89-8 Molecular Formula: C3H5ClO Molecular Weight (g/mol): 92.522 MDL Number: MFCD00005132 InChI Key: BRLQWZUYTZBJKN-UHFFFAOYSA-N Synonym: epichlorohydrin,2-chloromethyl oxirane,epichlorhydrin,1-chloro-2,3-epoxypropane,glycidyl chloride,oxirane, chloromethyl,epichlorhydrine,1,2-epoxy-3-chloropropane,2,3-epoxypropyl chloride,chloropropylene oxide PubChem CID: 7835 ChEBI: CHEBI:37144 IUPAC Name: 2-(chloromethyl)oxirane SMILES: C1C(O1)CCl
| PubChem CID | 7835 |
|---|---|
| CAS | 106-89-8 |
| Molecular Weight (g/mol) | 92.522 |
| ChEBI | CHEBI:37144 |
| MDL Number | MFCD00005132 |
| SMILES | C1C(O1)CCl |
| Synonym | epichlorohydrin,2-chloromethyl oxirane,epichlorhydrin,1-chloro-2,3-epoxypropane,glycidyl chloride,oxirane, chloromethyl,epichlorhydrine,1,2-epoxy-3-chloropropane,2,3-epoxypropyl chloride,chloropropylene oxide |
| IUPAC Name | 2-(chloromethyl)oxirane |
| InChI Key | BRLQWZUYTZBJKN-UHFFFAOYSA-N |
| Molecular Formula | C3H5ClO |