Organoheterocyclic compounds
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Thermo Scientific Chemicals Thiamine hydrochloride, 98.5-101.5%
CAS: 67-03-8 Formula molecolare: C12H17ClN4OS·HCl Molecular Weight (g/mol): 337.26 Numero MDL: MFCD00012780 InChI Key: DPJRMOMPQZCRJU-UHFFFAOYSA-M Sinonimo: thiamine hydrochloride,vitamin b1 hydrochloride,thiamine hcl,aneurine hydrochloride,berin,thiamine chloride hydrochloride,trophite,thiamin chloride,thiamine dichloride,thiaminium chloride PubChem CID: 6202 ChEBI: CHEBI:49105 IUPAC Name: 2-[3-[(4-ammino-2-metilpirimidina-5-il)metil]-4-metil-1,3-tiazol-3-io-5-il]etanolo;cloruro;cloridrato SMILES: CC1=C(SC=[N+]1CC2=CN=C(N=C2N)C)CCO.Cl.[Cl-]
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| Sinonimo | thiamine hydrochloride,vitamin b1 hydrochloride,thiamine hcl,aneurine hydrochloride,berin,thiamine chloride hydrochloride,trophite,thiamin chloride,thiamine dichloride,thiaminium chloride |
|---|---|
| Numero MDL | MFCD00012780 |
| PubChem CID | 6202 |
| Formula molecolare | C12H17ClN4OS·HCl |
| CAS | 67-03-8 |
| Molecular Weight (g/mol) | 337.26 |
| ChEBI | CHEBI:49105 |
| SMILES | CC1=C(SC=[N+]1CC2=CN=C(N=C2N)C)CCO.Cl.[Cl-] |
| IUPAC Name | 2-[3-[(4-ammino-2-metilpirimidina-5-il)metil]-4-metil-1,3-tiazol-3-io-5-il]etanolo;cloruro;cloridrato |
| InChI Key | DPJRMOMPQZCRJU-UHFFFAOYSA-M |
Pyridoxine hydrochloride, 99%
CAS: 58-56-0 Formula molecolare: C8H12ClNO3 Molecular Weight (g/mol): 205.638 Numero MDL: MFCD00012807 InChI Key: ZUFQODAHGAHPFQ-UHFFFAOYSA-N Sinonimo: pyridoxine hydrochloride,pyridoxine hcl,pyridoxol hydrochloride,vitamin b6,alestrol,becilan,benadon,hexavibex,hexermin,hexobion PubChem CID: 6019 ChEBI: CHEBI:30961 IUPAC Name: 4,5-bis(hydroxymethyl)-2-methylpyridin-3-ol;hydrochloride SMILES: CC1=NC=C(C(=C1O)CO)CO.Cl
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| Sinonimo | pyridoxine hydrochloride,pyridoxine hcl,pyridoxol hydrochloride,vitamin b6,alestrol,becilan,benadon,hexavibex,hexermin,hexobion |
|---|---|
| Numero MDL | MFCD00012807 |
| PubChem CID | 6019 |
| Formula molecolare | C8H12ClNO3 |
| CAS | 58-56-0 |
| Molecular Weight (g/mol) | 205.638 |
| ChEBI | CHEBI:30961 |
| SMILES | CC1=NC=C(C(=C1O)CO)CO.Cl |
| IUPAC Name | 4,5-bis(hydroxymethyl)-2-methylpyridin-3-ol;hydrochloride |
| InChI Key | ZUFQODAHGAHPFQ-UHFFFAOYSA-N |
Thermo Scientific Chemicals Cyanocobalamin, 96%
CAS: 68-19-9 Formula molecolare: C63H88CoN14O14P Molecular Weight (g/mol): 1355.38 Numero MDL: MFCD00151092 InChI Key: AGVAZMGAQJOSFJ-WZHZPDAFSA-M Sinonimo: vitamin b12 PubChem CID: 129893524 IUPAC Name: cobalt(2+);[(2R,3S,4R,5S)-5-(5,6-dimethylbenzimidazol-1-yl)-4-hydroxy-2-(hydroxymethyl)oxolan-3-yl] [(2R)-1-[3-[(1R,2R,3R,5Z,7S,10Z,12S,13S,15Z,17S,18S,19R)-2,13,18-tris(2-amino-2-oxoethyl)-7,12,17-tris(3-amino-3-oxopropyl)-3,5,8,8,13,15,18,19-octamethyl- SMILES: CC1=CC2=C(C=C1C)N(C=N2)C3C(C(C(O3)CO)OP(=O)(O)OC(C)CNC(=O)CCC4(C(C5C6(C(C(C(=C(C7=NC(=CC8=NC(=C(C4=N5)C)C(C8(C)C)CCC(=O)N)C(C7(C)CC(=O)N)CCC(=O)N)C)[N-]6)CCC(=O)N)(C)CC(=O)N)C)CC(=O)N)C)O.[C-]#N.[Co+2]
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| Sinonimo | vitamin b12 |
|---|---|
| Numero MDL | MFCD00151092 |
| PubChem CID | 129893524 |
| Formula molecolare | C63H88CoN14O14P |
| CAS | 68-19-9 |
| Molecular Weight (g/mol) | 1355.38 |
| SMILES | CC1=CC2=C(C=C1C)N(C=N2)C3C(C(C(O3)CO)OP(=O)(O)OC(C)CNC(=O)CCC4(C(C5C6(C(C(C(=C(C7=NC(=CC8=NC(=C(C4=N5)C)C(C8(C)C)CCC(=O)N)C(C7(C)CC(=O)N)CCC(=O)N)C)[N-]6)CCC(=O)N)(C)CC(=O)N)C)CC(=O)N)C)O.[C-]#N.[Co+2] |
| IUPAC Name | cobalt(2+);[(2R,3S,4R,5S)-5-(5,6-dimethylbenzimidazol-1-yl)-4-hydroxy-2-(hydroxymethyl)oxolan-3-yl] [(2R)-1-[3-[(1R,2R,3R,5Z,7S,10Z,12S,13S,15Z,17S,18S,19R)-2,13,18-tris(2-amino-2-oxoethyl)-7,12,17-tris(3-amino-3-oxopropyl)-3,5,8,8,13,15,18,19-octamethyl- |
| InChI Key | AGVAZMGAQJOSFJ-WZHZPDAFSA-M |
Propidium iodide, 1mg/ml aqueous soln.
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Thermo Scientific Chemicals Thiazolyl Blue tetrazolium bromide, 98%
CAS: 298-93-1 Formula molecolare: C18H16BrN5S Molecular Weight (g/mol): 414.33 Numero MDL: MFCD00011964,MFCD00066662 InChI Key: AZKSAVLVSZKNRD-UHFFFAOYSA-M Sinonimo: thiazolyl blue,thiazolyl blue tetrazolium bromide,mmt tetrazolium,methylthiazoletetrazolium,mtt,thiazolyl blue monotetrazolium,thiazole blue,3-4,5-dimethylthiazol-2-yl-2,5-diphenyltetrazolium bromide,mtt van,unii-euy85h477i PubChem CID: 64965 ChEBI: CHEBI:53233 IUPAC Name: 2-(3,5-diphenyltetrazol-2-ium-2-yl)-4,5-dimethyl-1,3-thiazole;bromide SMILES: [Br-].CC1=C(C)N=C(S1)[N+]1=NC(=NN1C1=CC=CC=C1)C1=CC=CC=C1
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| Sinonimo | thiazolyl blue,thiazolyl blue tetrazolium bromide,mmt tetrazolium,methylthiazoletetrazolium,mtt,thiazolyl blue monotetrazolium,thiazole blue,3-4,5-dimethylthiazol-2-yl-2,5-diphenyltetrazolium bromide,mtt van,unii-euy85h477i |
|---|---|
| Numero MDL | MFCD00011964,MFCD00066662 |
| PubChem CID | 64965 |
| Formula molecolare | C18H16BrN5S |
| CAS | 298-93-1 |
| Molecular Weight (g/mol) | 414.33 |
| ChEBI | CHEBI:53233 |
| SMILES | [Br-].CC1=C(C)N=C(S1)[N+]1=NC(=NN1C1=CC=CC=C1)C1=CC=CC=C1 |
| IUPAC Name | 2-(3,5-diphenyltetrazol-2-ium-2-yl)-4,5-dimethyl-1,3-thiazole;bromide |
| InChI Key | AZKSAVLVSZKNRD-UHFFFAOYSA-M |
Thermo Scientific Chemicals Quinine sulfate dihydrate, 99+%
CAS: 6119-70-6 Formula molecolare: C40H54N4O10S Molecular Weight (g/mol): 782.95 Numero MDL: MFCD00150790 InChI Key: ZHNFLHYOFXQIOW-OIGVVMIYNA-N PubChem CID: 134129495 IUPAC Name: (R)-[(2R,4R,5R)-5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl]-(6-methoxyquinolin-4-yl)methanol;sulfuric acid;tetrahydrate SMILES: O.O.OS(O)(=O)=O.[H][C@@]1(CN2CCC1C[C@@]2([H])[C@H](O)C1=C2C=C(OC)C=CC2=NC=C1)C=C.[H][C@@]1(CN2CCC1C[C@@]2([H])[C@H](O)C1=C2C=C(OC)C=CC2=NC=C1)C=C
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| Numero MDL | MFCD00150790 |
|---|---|
| PubChem CID | 134129495 |
| Formula molecolare | C40H54N4O10S |
| CAS | 6119-70-6 |
| Molecular Weight (g/mol) | 782.95 |
| SMILES | O.O.OS(O)(=O)=O.[H][C@@]1(CN2CCC1C[C@@]2([H])[C@H](O)C1=C2C=C(OC)C=CC2=NC=C1)C=C.[H][C@@]1(CN2CCC1C[C@@]2([H])[C@H](O)C1=C2C=C(OC)C=CC2=NC=C1)C=C |
| IUPAC Name | (R)-[(2R,4R,5R)-5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl]-(6-methoxyquinolin-4-yl)methanol;sulfuric acid;tetrahydrate |
| InChI Key | ZHNFLHYOFXQIOW-OIGVVMIYNA-N |
Melamine, 99%
CAS: 108-78-1 Formula molecolare: C3H6N6 Molecular Weight (g/mol): 126.12 Numero MDL: MFCD00006055 InChI Key: JDSHMPZPIAZGSV-UHFFFAOYSA-N Sinonimo: melamine,cyanurotriamide,cyanuramide,cyanurotriamine,isomelamine,theoharn,teoharn,triaminotriazine,cyanuric triamide,hicophor pr PubChem CID: 7955 ChEBI: CHEBI:27915 IUPAC Name: 1,3,5-triazine-2,4,6-triamine SMILES: NC1=NC(N)=NC(N)=N1
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| Sinonimo | melamine,cyanurotriamide,cyanuramide,cyanurotriamine,isomelamine,theoharn,teoharn,triaminotriazine,cyanuric triamide,hicophor pr |
|---|---|
| Numero MDL | MFCD00006055 |
| PubChem CID | 7955 |
| Formula molecolare | C3H6N6 |
| CAS | 108-78-1 |
| Molecular Weight (g/mol) | 126.12 |
| ChEBI | CHEBI:27915 |
| SMILES | NC1=NC(N)=NC(N)=N1 |
| IUPAC Name | 1,3,5-triazine-2,4,6-triamine |
| InChI Key | JDSHMPZPIAZGSV-UHFFFAOYSA-N |
N-Vinyl-2-pyrrolidone, 99%, stabilized with NaOH
CAS: 88-12-0 Formula molecolare: C6H9NO Molecular Weight (g/mol): 111.14 Numero MDL: MFCD00003197 InChI Key: WHNWPMSKXPGLAX-UHFFFAOYSA-N Sinonimo: n-vinyl-2-pyrrolidone,n-vinylpyrrolidone,1-vinyl-2-pyrrolidone,1-vinylpyrrolidin-2-one,n-vinyl-2-pyrrolidinone,vinylpyrrolidone,2-pyrrolidinone, 1-ethenyl,1-vinyl-2-pyrrolidinone,n-vinylpyrrolidinone,1-vinylpyrrolidone PubChem CID: 6917 ChEBI: CHEBI:82551 IUPAC Name: 1-ethenylpyrrolidin-2-one SMILES: C=CN1CCCC1=O
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| Sinonimo | n-vinyl-2-pyrrolidone,n-vinylpyrrolidone,1-vinyl-2-pyrrolidone,1-vinylpyrrolidin-2-one,n-vinyl-2-pyrrolidinone,vinylpyrrolidone,2-pyrrolidinone, 1-ethenyl,1-vinyl-2-pyrrolidinone,n-vinylpyrrolidinone,1-vinylpyrrolidone |
|---|---|
| Numero MDL | MFCD00003197 |
| PubChem CID | 6917 |
| Formula molecolare | C6H9NO |
| CAS | 88-12-0 |
| Molecular Weight (g/mol) | 111.14 |
| ChEBI | CHEBI:82551 |
| SMILES | C=CN1CCCC1=O |
| IUPAC Name | 1-ethenylpyrrolidin-2-one |
| InChI Key | WHNWPMSKXPGLAX-UHFFFAOYSA-N |
N-Hydroxysuccinimide, 98+%
CAS: 6066-82-6 Formula molecolare: C4H5NO3 Molecular Weight (g/mol): 115.088 Numero MDL: MFCD00005516 InChI Key: NQTADLQHYWFPDB-UHFFFAOYSA-N Sinonimo: n-hydroxysuccinimide,hosu,1-hydroxysuccinimide,2,5-pyrrolidinedione, 1-hydroxy,1-hydroxy-2,5-pyrrolidinedione,succinimide, n-hydroxy,n-hydroxysuccinimde,n-hydroxysuccinimid,unii-mje3791m4t,ccris 2604 PubChem CID: 80170 IUPAC Name: 1-hydroxypyrrolidine-2,5-dione SMILES: C1CC(=O)N(C1=O)O
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| Sinonimo | n-hydroxysuccinimide,hosu,1-hydroxysuccinimide,2,5-pyrrolidinedione, 1-hydroxy,1-hydroxy-2,5-pyrrolidinedione,succinimide, n-hydroxy,n-hydroxysuccinimde,n-hydroxysuccinimid,unii-mje3791m4t,ccris 2604 |
|---|---|
| Numero MDL | MFCD00005516 |
| PubChem CID | 80170 |
| Formula molecolare | C4H5NO3 |
| CAS | 6066-82-6 |
| Molecular Weight (g/mol) | 115.088 |
| SMILES | C1CC(=O)N(C1=O)O |
| IUPAC Name | 1-hydroxypyrrolidine-2,5-dione |
| InChI Key | NQTADLQHYWFPDB-UHFFFAOYSA-N |
Serotonin hydrochloride, 98%
CAS: 153-98-0 Formula molecolare: C10H13ClN2O Molecular Weight (g/mol): 212.677 Numero MDL: MFCD00012686 InChI Key: MDIGAZPGKJFIAH-UHFFFAOYSA-N Sinonimo: serotonin hydrochloride,5-hydroxytryptamine hydrochloride,3-2-aminoethyl-1h-indol-5-ol hydrochloride,serotonin hcl,5-hydroxytryptamine hcl,unii-gkn429m9vs,ccris 4420,1h-indol-5-ol, 3-2-aminoethyl-, monohydrochloride,gkn429m9vs,3-2-aminoethyl indol-5-ol, chloride PubChem CID: 160436 IUPAC Name: 3-(2-aminoethyl)-1H-indol-5-ol;hydrochloride SMILES: C1=CC2=C(C=C1O)C(=CN2)CCN.Cl
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| Sinonimo | serotonin hydrochloride,5-hydroxytryptamine hydrochloride,3-2-aminoethyl-1h-indol-5-ol hydrochloride,serotonin hcl,5-hydroxytryptamine hcl,unii-gkn429m9vs,ccris 4420,1h-indol-5-ol, 3-2-aminoethyl-, monohydrochloride,gkn429m9vs,3-2-aminoethyl indol-5-ol, chloride |
|---|---|
| Numero MDL | MFCD00012686 |
| PubChem CID | 160436 |
| Formula molecolare | C10H13ClN2O |
| CAS | 153-98-0 |
| Molecular Weight (g/mol) | 212.677 |
| SMILES | C1=CC2=C(C=C1O)C(=CN2)CCN.Cl |
| IUPAC Name | 3-(2-aminoethyl)-1H-indol-5-ol;hydrochloride |
| InChI Key | MDIGAZPGKJFIAH-UHFFFAOYSA-N |
Caffeine, 98.5%, specified according to the req. of USP/BP
CAS: 58-08-2 Formula molecolare: C8H10N4O2 Molecular Weight (g/mol): 194.19 Numero MDL: MFCD00005758 InChI Key: RYYVLZVUVIJVGH-UHFFFAOYSA-N Sinonimo: caffeine,1,3,7-trimethylxanthine,guaranine,thein,cafeina,methyltheobromine,koffein,mateina,theine,alert-pep PubChem CID: 2519 ChEBI: CHEBI:27732 IUPAC Name: 1,3,7-trimethylpurine-2,6-dione SMILES: CN1C=NC2=C1C(=O)N(C)C(=O)N2C
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| Sinonimo | caffeine,1,3,7-trimethylxanthine,guaranine,thein,cafeina,methyltheobromine,koffein,mateina,theine,alert-pep |
|---|---|
| Numero MDL | MFCD00005758 |
| PubChem CID | 2519 |
| Formula molecolare | C8H10N4O2 |
| CAS | 58-08-2 |
| Molecular Weight (g/mol) | 194.19 |
| ChEBI | CHEBI:27732 |
| SMILES | CN1C=NC2=C1C(=O)N(C)C(=O)N2C |
| IUPAC Name | 1,3,7-trimethylpurine-2,6-dione |
| InChI Key | RYYVLZVUVIJVGH-UHFFFAOYSA-N |
Thermo Scientific Chemicals DL-Thioctic Acid, 98+%
CAS: 1077-28-7 Formula molecolare: C8H14O2S2 Molecular Weight (g/mol): 206.32 Numero MDL: MFCD00005474 InChI Key: AGBQKNBQESQNJD-UHFFFAOYNA-N Sinonimo: dl-thioctic acid,thioctic acid,alpha-lipoic acid,5-1,2-dithiolan-3-yl pentanoic acid,dl-alpha-lipoic acid,1,2-dithiolane-3-pentanoic acid,6,8-thioctic acid,thioctacid,6-thioctic acid,alpha lipoic acid PubChem CID: 864 ChEBI: CHEBI:16494 IUPAC Name: 5-(dithiolan-3-yl)pentanoic acid SMILES: OC(=O)CCCCC1CCSS1
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| Sinonimo | dl-thioctic acid,thioctic acid,alpha-lipoic acid,5-1,2-dithiolan-3-yl pentanoic acid,dl-alpha-lipoic acid,1,2-dithiolane-3-pentanoic acid,6,8-thioctic acid,thioctacid,6-thioctic acid,alpha lipoic acid |
|---|---|
| Numero MDL | MFCD00005474 |
| PubChem CID | 864 |
| Formula molecolare | C8H14O2S2 |
| CAS | 1077-28-7 |
| Molecular Weight (g/mol) | 206.32 |
| ChEBI | CHEBI:16494 |
| SMILES | OC(=O)CCCCC1CCSS1 |
| IUPAC Name | 5-(dithiolan-3-yl)pentanoic acid |
| InChI Key | AGBQKNBQESQNJD-UHFFFAOYNA-N |
3-Aminophthalhydrazide, 98%
CAS: 521-31-3 Formula molecolare: C8H7N3O2 Molecular Weight (g/mol): 177.163 Numero MDL: MFCD00006890 InChI Key: HWYHZTIRURJOHG-UHFFFAOYSA-N Sinonimo: luminol,3-aminophthalhydrazide,3-aminophthalic hydrazide,5-amino-2,3-dihydro-1,4-phthalazinedione,1,4-phthalazinedione, 5-amino-2,3-dihydro,3-aminophthalic acid hydrazide,5-amino-1,2,3,4-tetrahydrophthalazine-1,4-dione,unii-5exp385q4f,ccris 5962,3-aminophthalylhydrazide PubChem CID: 10638 IUPAC Name: 5-amino-2,3-dihydrophthalazine-1,4-dione SMILES: C1=CC2=C(C(=C1)N)C(=O)NNC2=O
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| Sinonimo | luminol,3-aminophthalhydrazide,3-aminophthalic hydrazide,5-amino-2,3-dihydro-1,4-phthalazinedione,1,4-phthalazinedione, 5-amino-2,3-dihydro,3-aminophthalic acid hydrazide,5-amino-1,2,3,4-tetrahydrophthalazine-1,4-dione,unii-5exp385q4f,ccris 5962,3-aminophthalylhydrazide |
|---|---|
| Numero MDL | MFCD00006890 |
| PubChem CID | 10638 |
| Formula molecolare | C8H7N3O2 |
| CAS | 521-31-3 |
| Molecular Weight (g/mol) | 177.163 |
| SMILES | C1=CC2=C(C(=C1)N)C(=O)NNC2=O |
| IUPAC Name | 5-amino-2,3-dihydrophthalazine-1,4-dione |
| InChI Key | HWYHZTIRURJOHG-UHFFFAOYSA-N |
Quinine, 98+%, anhydrous
CAS: 130-95-0 Formula molecolare: C20H24N2O2 Molecular Weight (g/mol): 324.42 Numero MDL: MFCD00198096 InChI Key: LOUPRKONTZGTKE-ZCXAXGJJNA-N Sinonimo: 1r-6-methoxyquinolin-4-yl 1s,4s,5r-5-vinylquinuclidin-2-yl methanol,quinine anhydrous,+-2,3-o-isopropylidene-l-threitol PubChem CID: 129316724 IUPAC Name: (5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl)-[6-(trideuteriomethoxy)quinolin-4-yl]methanol SMILES: [H][C@@]1(CN2CCC1C[C@@]2([H])[C@H](O)C1=C2C=C(OC)C=CC2=NC=C1)C=C
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| Sinonimo | 1r-6-methoxyquinolin-4-yl 1s,4s,5r-5-vinylquinuclidin-2-yl methanol,quinine anhydrous,+-2,3-o-isopropylidene-l-threitol |
|---|---|
| Numero MDL | MFCD00198096 |
| PubChem CID | 129316724 |
| Formula molecolare | C20H24N2O2 |
| CAS | 130-95-0 |
| Molecular Weight (g/mol) | 324.42 |
| SMILES | [H][C@@]1(CN2CCC1C[C@@]2([H])[C@H](O)C1=C2C=C(OC)C=CC2=NC=C1)C=C |
| IUPAC Name | (5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl)-[6-(trideuteriomethoxy)quinolin-4-yl]methanol |
| InChI Key | LOUPRKONTZGTKE-ZCXAXGJJNA-N |
D-Biotin, Fisher BioReagents
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