Organoheterocyclic compounds
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5-Fluorouracil 99.0+%, TCI America™
CAS: 51-21-8 Molecular Formula: C4H3FN2O2 Molecular Weight (g/mol): 130.08 MDL Number: MFCD00006018 InChI Key: GHASVSINZRGABV-UHFFFAOYSA-N Synonym: 5-fluorouracil,fluorouracil,5-fu,fluoroplex,adrucil,efudex,carac,fluracil,fluoroblastin,kecimeton PubChem CID: 3385 ChEBI: CHEBI:46345 IUPAC Name: 5-fluoro-1,2,3,4-tetrahydropyrimidine-2,4-dione SMILES: FC1=CNC(=O)NC1=O
| PubChem CID | 3385 |
|---|---|
| CAS | 51-21-8 |
| Molecular Weight (g/mol) | 130.08 |
| ChEBI | CHEBI:46345 |
| MDL Number | MFCD00006018 |
| SMILES | FC1=CNC(=O)NC1=O |
| Synonym | 5-fluorouracil,fluorouracil,5-fu,fluoroplex,adrucil,efudex,carac,fluracil,fluoroblastin,kecimeton |
| IUPAC Name | 5-fluoro-1,2,3,4-tetrahydropyrimidine-2,4-dione |
| InChI Key | GHASVSINZRGABV-UHFFFAOYSA-N |
| Molecular Formula | C4H3FN2O2 |
D-(+)-Cycloserine 98.0+%, TCI America™
CAS: 68-41-7 Molecular Formula: C3H6N2O2 Molecular Weight (g/mol): 102.093 MDL Number: MFCD00005353 InChI Key: DYDCUQKUCUHJBH-UWTATZPHSA-N Synonym: d-cycloserine,cycloserine,seromycin,orientomycin,oxamycin,cyclorin,cyclo-d-serine,cicloserina,farmiserina,miroseryn PubChem CID: 6234 ChEBI: CHEBI:40009 IUPAC Name: (4R)-4-amino-1,2-oxazolidin-3-one SMILES: C1C(C(=O)NO1)N
| PubChem CID | 6234 |
|---|---|
| CAS | 68-41-7 |
| Molecular Weight (g/mol) | 102.093 |
| ChEBI | CHEBI:40009 |
| MDL Number | MFCD00005353 |
| SMILES | C1C(C(=O)NO1)N |
| Synonym | d-cycloserine,cycloserine,seromycin,orientomycin,oxamycin,cyclorin,cyclo-d-serine,cicloserina,farmiserina,miroseryn |
| IUPAC Name | (4R)-4-amino-1,2-oxazolidin-3-one |
| InChI Key | DYDCUQKUCUHJBH-UWTATZPHSA-N |
| Molecular Formula | C3H6N2O2 |
N-Ethylmaleimide, 98+%
CAS: 128-53-0 Molecular Formula: C6H7NO2 Molecular Weight (g/mol): 125.127 MDL Number: MFCD00005509 InChI Key: HDFGOPSGAURCEO-UHFFFAOYSA-N Synonym: n-ethylmaleimide,ethylmaleimide,1-ethyl-1h-pyrrole-2,5-dione,maleimide, n-ethyl,1h-pyrrole-2,5-dione, 1-ethyl,maleic acid n-ethylimide,nem,usaf b-121,unii-o3c74acm9v,maleic acid-n-ethylimide PubChem CID: 4362 ChEBI: CHEBI:44485 IUPAC Name: 1-ethylpyrrole-2,5-dione SMILES: CCN1C(=O)C=CC1=O
| PubChem CID | 4362 |
|---|---|
| CAS | 128-53-0 |
| Molecular Weight (g/mol) | 125.127 |
| ChEBI | CHEBI:44485 |
| MDL Number | MFCD00005509 |
| SMILES | CCN1C(=O)C=CC1=O |
| Synonym | n-ethylmaleimide,ethylmaleimide,1-ethyl-1h-pyrrole-2,5-dione,maleimide, n-ethyl,1h-pyrrole-2,5-dione, 1-ethyl,maleic acid n-ethylimide,nem,usaf b-121,unii-o3c74acm9v,maleic acid-n-ethylimide |
| IUPAC Name | 1-ethylpyrrole-2,5-dione |
| InChI Key | HDFGOPSGAURCEO-UHFFFAOYSA-N |
| Molecular Formula | C6H7NO2 |
Furfuryl mercaptan, 98+%
CAS: 98-02-2 Molecular Formula: C5H6OS Molecular Weight (g/mol): 114.162 MDL Number: MFCD00003254 InChI Key: ZFFTZDQKIXPDAF-UHFFFAOYSA-N Synonym: furfuryl mercaptan,2-furanmethanethiol,2-furylmethanethiol,furfuryl thiol,2-furylmethyl mercaptan,2-furfurylmercaptan,furan-2-yl-methanethiol,2-mercaptomethyl furan,furfurylmercaptan,2-furfurylthiol PubChem CID: 7363 IUPAC Name: furan-2-ylmethanethiol SMILES: C1=COC(=C1)CS
| PubChem CID | 7363 |
|---|---|
| CAS | 98-02-2 |
| Molecular Weight (g/mol) | 114.162 |
| MDL Number | MFCD00003254 |
| SMILES | C1=COC(=C1)CS |
| Synonym | furfuryl mercaptan,2-furanmethanethiol,2-furylmethanethiol,furfuryl thiol,2-furylmethyl mercaptan,2-furfurylmercaptan,furan-2-yl-methanethiol,2-mercaptomethyl furan,furfurylmercaptan,2-furfurylthiol |
| IUPAC Name | furan-2-ylmethanethiol |
| InChI Key | ZFFTZDQKIXPDAF-UHFFFAOYSA-N |
| Molecular Formula | C5H6OS |
Disuccinimidyl glutarate, 97%
CAS: 79642-50-5 Molecular Formula: C13H14N2O8 Molecular Weight (g/mol): 326.26 MDL Number: MFCD00153597 InChI Key: LNQHREYHFRFJAU-UHFFFAOYSA-N Synonym: disuccinimidyl glutarate,di n-succinimidyl glutarate,bis 2,5-dioxopyrrolidin-1-yl pentanedioate,pentanedioic acid,1,5-bis 2,5-dioxo-1-pyrrolidinyl ester,dsg crosslinker,glutaric acid disuccinimidyl ester,di n-hydroxysuccinimidyl glutarate,bis 2,5-dioxopyrrolidin-1-yl glutarate,di n-succinimidyl glutarate chn PubChem CID: 4432628 IUPAC Name: bis(2,5-dioxopyrrolidin-1-yl) pentanedioate SMILES: O=C(CCCC(=O)ON1C(=O)CCC1=O)ON1C(=O)CCC1=O
| PubChem CID | 4432628 |
|---|---|
| CAS | 79642-50-5 |
| Molecular Weight (g/mol) | 326.26 |
| MDL Number | MFCD00153597 |
| SMILES | O=C(CCCC(=O)ON1C(=O)CCC1=O)ON1C(=O)CCC1=O |
| Synonym | disuccinimidyl glutarate,di n-succinimidyl glutarate,bis 2,5-dioxopyrrolidin-1-yl pentanedioate,pentanedioic acid,1,5-bis 2,5-dioxo-1-pyrrolidinyl ester,dsg crosslinker,glutaric acid disuccinimidyl ester,di n-hydroxysuccinimidyl glutarate,bis 2,5-dioxopyrrolidin-1-yl glutarate,di n-succinimidyl glutarate chn |
| IUPAC Name | bis(2,5-dioxopyrrolidin-1-yl) pentanedioate |
| InChI Key | LNQHREYHFRFJAU-UHFFFAOYSA-N |
| Molecular Formula | C13H14N2O8 |
Thiophene, 99+%, extra pure
CAS: 110-02-1 Molecular Formula: C4H4S Molecular Weight (g/mol): 84.14 MDL Number: MFCD00005413 InChI Key: YTPLMLYBLZKORZ-UHFFFAOYSA-N Synonym: thiofuran,thiole,thiophen,thiotetrole,thiacyclopentadiene,divinylene sulfide,thiaphene,thiofuram,thiofurfuran,furan, thio PubChem CID: 8030 ChEBI: CHEBI:30856 IUPAC Name: thiophene SMILES: S1C=CC=C1
| PubChem CID | 8030 |
|---|---|
| CAS | 110-02-1 |
| Molecular Weight (g/mol) | 84.14 |
| ChEBI | CHEBI:30856 |
| MDL Number | MFCD00005413 |
| SMILES | S1C=CC=C1 |
| Synonym | thiofuran,thiole,thiophen,thiotetrole,thiacyclopentadiene,divinylene sulfide,thiaphene,thiofuram,thiofurfuran,furan, thio |
| IUPAC Name | thiophene |
| InChI Key | YTPLMLYBLZKORZ-UHFFFAOYSA-N |
| Molecular Formula | C4H4S |
Hemin, 95%, MP Biomedicals™
CAS: 16009-13-5 Molecular Formula: C34H32ClFeN4O4 Molecular Weight (g/mol): 651.95 MDL Number: MFCD00010726 InChI Key: BTIJJDXEELBZFS-HXFTUNQESA-K Synonym: chlorohemin,hemin chloride,protoferriheme,ferriheme,ferriprotoporphyrin ix chloride,ferriprotoporphyrin ix,panhematin,protohemin,protohemin ix,ferriprotoporphyrin PubChem CID: 131675604 IUPAC Name: 3-[(1Z,6Z,12Z,17Z)-5-(2-carboxyethyl)-22-chloro-15,20-diethenyl-4,10,14,19-tetramethyl-21,23,24,25-tetraaza-22-ferrahexacyclo[9.9.3.1³,⁶.1¹³,¹⁶.0⁸,²³.0¹⁸,²¹]pentacosa-1,3(25),4,6,8,10,12,14,16(24),17,19-undecaen-9-yl]propanoic acid SMILES: CC1=C(CCC(O)=O)\C2=C\C3=C(CCC(O)=O)C(C)=C4\C=C5/N=C(/C=C6\N([Fe](Cl)N34)\C(=C/C1=N2)C(C=C)=C6C)C(C=C)=C5C
| PubChem CID | 131675604 |
|---|---|
| CAS | 16009-13-5 |
| Molecular Weight (g/mol) | 651.95 |
| MDL Number | MFCD00010726 |
| SMILES | CC1=C(CCC(O)=O)\C2=C\C3=C(CCC(O)=O)C(C)=C4\C=C5/N=C(/C=C6\N([Fe](Cl)N34)\C(=C/C1=N2)C(C=C)=C6C)C(C=C)=C5C |
| Synonym | chlorohemin,hemin chloride,protoferriheme,ferriheme,ferriprotoporphyrin ix chloride,ferriprotoporphyrin ix,panhematin,protohemin,protohemin ix,ferriprotoporphyrin |
| IUPAC Name | 3-[(1Z,6Z,12Z,17Z)-5-(2-carboxyethyl)-22-chloro-15,20-diethenyl-4,10,14,19-tetramethyl-21,23,24,25-tetraaza-22-ferrahexacyclo[9.9.3.1³,⁶.1¹³,¹⁶.0⁸,²³.0¹⁸,²¹]pentacosa-1,3(25),4,6,8,10,12,14,16(24),17,19-undecaen-9-yl]propanoic acid |
| InChI Key | BTIJJDXEELBZFS-HXFTUNQESA-K |
| Molecular Formula | C34H32ClFeN4O4 |
Thiamine hydrochloride, 99% (dry wt.), may cont. up to 5% water
CAS: 67-03-8 Molecular Formula: C12H18Cl2N4OS Molecular Weight (g/mol): 337.263 MDL Number: MFCD00012780 InChI Key: DPJRMOMPQZCRJU-UHFFFAOYSA-M Synonym: 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-amino-2-methylpyrimidin-5-yl)methyl]-4-methyl-1,3-thiazol-3-ium-5-yl]ethanol;chloride;hydrochloride SMILES: CC1=C(SC=[N+]1CC2=CN=C(N=C2N)C)CCO.Cl.[Cl-]
| PubChem CID | 6202 |
|---|---|
| CAS | 67-03-8 |
| Molecular Weight (g/mol) | 337.263 |
| ChEBI | CHEBI:49105 |
| MDL Number | MFCD00012780 |
| SMILES | CC1=C(SC=[N+]1CC2=CN=C(N=C2N)C)CCO.Cl.[Cl-] |
| Synonym | thiamine hydrochloride,vitamin b1 hydrochloride,thiamine hcl,aneurine hydrochloride,berin,thiamine chloride hydrochloride,trophite,thiamin chloride,thiamine dichloride,thiaminium chloride |
| IUPAC Name | 2-[3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-4-methyl-1,3-thiazol-3-ium-5-yl]ethanol;chloride;hydrochloride |
| InChI Key | DPJRMOMPQZCRJU-UHFFFAOYSA-M |
| Molecular Formula | C12H18Cl2N4OS |
2-(Methylamino)pyridine, 98%
CAS: 4597-87-9 Molecular Formula: C6H8N2 Molecular Weight (g/mol): 108.14 MDL Number: MFCD00006250 InChI Key: SVEUVITYHIHZQE-UHFFFAOYSA-N Synonym: 2-methylamino pyridine,2-methylaminopyridine,2-pyridinamine, n-methyl,methylamino-2 pyridine,n-2-pyridylmethylamine,pyridine, 2-methylamino,n-methyl-2-pyridinamine,2-pyridinamine, n-methyl-9ci,n-methyl pyridimine PubChem CID: 20727 IUPAC Name: N-methylpyridin-2-amine SMILES: CNC1=CC=CC=N1
| PubChem CID | 20727 |
|---|---|
| CAS | 4597-87-9 |
| Molecular Weight (g/mol) | 108.14 |
| MDL Number | MFCD00006250 |
| SMILES | CNC1=CC=CC=N1 |
| Synonym | 2-methylamino pyridine,2-methylaminopyridine,2-pyridinamine, n-methyl,methylamino-2 pyridine,n-2-pyridylmethylamine,pyridine, 2-methylamino,n-methyl-2-pyridinamine,2-pyridinamine, n-methyl-9ci,n-methyl pyridimine |
| IUPAC Name | N-methylpyridin-2-amine |
| InChI Key | SVEUVITYHIHZQE-UHFFFAOYSA-N |
| Molecular Formula | C6H8N2 |
Biotin 98.0+%, TCI America™
CAS: 58-85-5 Molecular Formula: C10H16N2O3S Molecular Weight (g/mol): 244.31 MDL Number: MFCD00005541 InChI Key: YBJHBAHKTGYVGT-UHFFFAOYNA-N Synonym: biotin,d-biotin,vitamin h,coenzyme r,vitamin b7,bios ii,factor s,bioepiderm,d +-biotin,biodermatin PubChem CID: 171548 ChEBI: CHEBI:15956 IUPAC Name: 5-{2-oxo-hexahydro-1H-thieno[3,4-d]imidazol-4-yl}pentanoic acid SMILES: OC(=O)CCCCC1SCC2NC(=O)NC12
| PubChem CID | 171548 |
|---|---|
| CAS | 58-85-5 |
| Molecular Weight (g/mol) | 244.31 |
| ChEBI | CHEBI:15956 |
| MDL Number | MFCD00005541 |
| SMILES | OC(=O)CCCCC1SCC2NC(=O)NC12 |
| Synonym | biotin,d-biotin,vitamin h,coenzyme r,vitamin b7,bios ii,factor s,bioepiderm,d +-biotin,biodermatin |
| IUPAC Name | 5-{2-oxo-hexahydro-1H-thieno[3,4-d]imidazol-4-yl}pentanoic acid |
| InChI Key | YBJHBAHKTGYVGT-UHFFFAOYNA-N |
| Molecular Formula | C10H16N2O3S |
Quinine, 98+%, anhydrous
CAS: 130-95-0 Molecular Formula: C20H24N2O2 Molecular Weight (g/mol): 324.42 MDL Number: MFCD00198096 InChI Key: LOUPRKONTZGTKE-ZCXAXGJJNA-N Synonym: 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
| PubChem CID | 129316724 |
|---|---|
| CAS | 130-95-0 |
| Molecular Weight (g/mol) | 324.42 |
| MDL Number | MFCD00198096 |
| SMILES | [H][C@@]1(CN2CCC1C[C@@]2([H])[C@H](O)C1=C2C=C(OC)C=CC2=NC=C1)C=C |
| Synonym | 1r-6-methoxyquinolin-4-yl 1s,4s,5r-5-vinylquinuclidin-2-yl methanol,quinine anhydrous,+-2,3-o-isopropylidene-l-threitol |
| IUPAC Name | (5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl)-[6-(trideuteriomethoxy)quinolin-4-yl]methanol |
| InChI Key | LOUPRKONTZGTKE-ZCXAXGJJNA-N |
| Molecular Formula | C20H24N2O2 |
Glycidol, 96%
CAS: 556-52-5 Molecular Formula: C3H6O2 Molecular Weight (g/mol): 74.08 MDL Number: MFCD00005147,MFCD00074873 InChI Key: CTKINSOISVBQLD-UHFFFAOYNA-N Synonym: glycidol,oxiranemethanol,2,3-epoxy-1-propanol,epihydrin alcohol,glycide,oxiranylmethanol,3-hydroxypropylene oxide,1-propanol, 2,3-epoxy,2,3-epoxypropanol,glycidyl alcohol PubChem CID: 11164 ChEBI: CHEBI:30966 IUPAC Name: oxiran-2-ylmethanol SMILES: OCC1CO1
| PubChem CID | 11164 |
|---|---|
| CAS | 556-52-5 |
| Molecular Weight (g/mol) | 74.08 |
| ChEBI | CHEBI:30966 |
| MDL Number | MFCD00005147,MFCD00074873 |
| SMILES | OCC1CO1 |
| Synonym | glycidol,oxiranemethanol,2,3-epoxy-1-propanol,epihydrin alcohol,glycide,oxiranylmethanol,3-hydroxypropylene oxide,1-propanol, 2,3-epoxy,2,3-epoxypropanol,glycidyl alcohol |
| IUPAC Name | oxiran-2-ylmethanol |
| InChI Key | CTKINSOISVBQLD-UHFFFAOYNA-N |
| Molecular Formula | C3H6O2 |
2,6-Di-tert-butyl-4-methylpyridine, 97%
CAS: 38222-83-2 Molecular Formula: C14H23N Molecular Weight (g/mol): 205.35 MDL Number: MFCD00006305 InChI Key: HVHZEKKZMFRULH-UHFFFAOYSA-N Synonym: 2,6-di-tert-butyl-4-methylpyridine,dtbmp,pyridine, 2,6-bis 1,1-dimethylethyl-4-methyl,2,6-di-t-butyl-4-methylpyridine,2,6-ditert-butyl-4-methyl-pyridine,2,6-bis tert-butyl-4-methylpyridine,pubchem10244,acmc-209iyr,ksc490s2n,2,6-di-t-butyl 4-methylpyridine PubChem CID: 98898 SMILES: CC1=CC(=NC(=C1)C(C)(C)C)C(C)(C)C
| PubChem CID | 98898 |
|---|---|
| CAS | 38222-83-2 |
| Molecular Weight (g/mol) | 205.35 |
| MDL Number | MFCD00006305 |
| SMILES | CC1=CC(=NC(=C1)C(C)(C)C)C(C)(C)C |
| Synonym | 2,6-di-tert-butyl-4-methylpyridine,dtbmp,pyridine, 2,6-bis 1,1-dimethylethyl-4-methyl,2,6-di-t-butyl-4-methylpyridine,2,6-ditert-butyl-4-methyl-pyridine,2,6-bis tert-butyl-4-methylpyridine,pubchem10244,acmc-209iyr,ksc490s2n,2,6-di-t-butyl 4-methylpyridine |
| InChI Key | HVHZEKKZMFRULH-UHFFFAOYSA-N |
| Molecular Formula | C14H23N |
Ethyl viologen dibromide, 97%
CAS: 53721-12-3 Molecular Formula: C14H18Br2N2 Molecular Weight (g/mol): 374.11 InChI Key: LCEBDKLPALDQPV-UHFFFAOYSA-L Synonym: ethyl viologen dibromide,1,1'-diethyl-4,4'-bipyridinium dibromide,4,4'-bipyridinium, 1,1'-diethyl-, dibromide,ethylviologen dibromide,1,1'-diethyl-4,4'-bipyridiniumdibromide,1,1/'-diethyl-4,4/'-bipyridinium dibromide,1,1-diethyl-4,4-bipyridinium dibromide,1,1'-diethyl-4,4'-bipyridine-1,1'-diium bromide,1-ethyl-4-1-ethyl 4-pyridyl pyridine, bromide, bromide PubChem CID: 11474262 IUPAC Name: 1-ethyl-4-(1-ethylpyridin-1-ium-4-yl)pyridin-1-ium;dibromide SMILES: CC[N+]1=CC=C(C=C1)C2=CC=[N+](C=C2)CC.[Br-].[Br-]
| PubChem CID | 11474262 |
|---|---|
| CAS | 53721-12-3 |
| Molecular Weight (g/mol) | 374.11 |
| SMILES | CC[N+]1=CC=C(C=C1)C2=CC=[N+](C=C2)CC.[Br-].[Br-] |
| Synonym | ethyl viologen dibromide,1,1'-diethyl-4,4'-bipyridinium dibromide,4,4'-bipyridinium, 1,1'-diethyl-, dibromide,ethylviologen dibromide,1,1'-diethyl-4,4'-bipyridiniumdibromide,1,1/'-diethyl-4,4/'-bipyridinium dibromide,1,1-diethyl-4,4-bipyridinium dibromide,1,1'-diethyl-4,4'-bipyridine-1,1'-diium bromide,1-ethyl-4-1-ethyl 4-pyridyl pyridine, bromide, bromide |
| IUPAC Name | 1-ethyl-4-(1-ethylpyridin-1-ium-4-yl)pyridin-1-ium;dibromide |
| InChI Key | LCEBDKLPALDQPV-UHFFFAOYSA-L |
| Molecular Formula | C14H18Br2N2 |
2-Hydroxypyridine N-oxide, 98+%
CAS: 13161-30-3 Molecular Formula: C5H5NO2 Molecular Weight (g/mol): 111.1 MDL Number: MFCD00006195 InChI Key: SNUSZUYTMHKCPM-UHFFFAOYSA-N Synonym: 2-pyridinol-1-oxide,2-hydroxypyridine 1-oxide,2-hydroxypyridine n-oxide,1-hydroxypyridin-2 1h-one,2-hydroxypyridine-n-oxide,hydroxypyridinone,pyridinol, 1-oxide,2-pyridinol 1-oxide,1-hydroxy-2-pyridone,1-hydroxy-1,2-dihydropyridin-2-one PubChem CID: 69975 IUPAC Name: 1-hydroxypyridin-2-one SMILES: C1=CC(=O)N(C=C1)O
| PubChem CID | 69975 |
|---|---|
| CAS | 13161-30-3 |
| Molecular Weight (g/mol) | 111.1 |
| MDL Number | MFCD00006195 |
| SMILES | C1=CC(=O)N(C=C1)O |
| Synonym | 2-pyridinol-1-oxide,2-hydroxypyridine 1-oxide,2-hydroxypyridine n-oxide,1-hydroxypyridin-2 1h-one,2-hydroxypyridine-n-oxide,hydroxypyridinone,pyridinol, 1-oxide,2-pyridinol 1-oxide,1-hydroxy-2-pyridone,1-hydroxy-1,2-dihydropyridin-2-one |
| IUPAC Name | 1-hydroxypyridin-2-one |
| InChI Key | SNUSZUYTMHKCPM-UHFFFAOYSA-N |
| Molecular Formula | C5H5NO2 |