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Organoheterocyclic compounds

Organic compounds that consist of ring structures, or cyclic compounds that have atoms of at least two different elements as members of its ring(s).
Phenanthrolines (8)
Heteroaromatic compounds (5)
Azoles (5)
Pyridines and derivatives (3)
Quinolines and derivatives (2)
Benzoxazoles (1)
Indoles and derivatives (1)
Isobenzofurans (1)
Pyrimidines And Derivatives (1)

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1 – 15 of 15 results
1

8-Hydroxyquinoline (White to Light-Buff Needles or Powder), Fisher BioReagents

CAS: 148-24-3 Molecular Formula: C9H7NO Molecular Weight (g/mol): 145.16 MDL Number: MFCD00006807 InChI Key: MCJGNVYPOGVAJF-UHFFFAOYSA-N Synonym: 8-hydroxyquinoline,8-quinolinol,oxyquinoline,oxine,quinophenol,8-quinol,8-oxyquinoline,phenopyridine,oxychinolin,bioquin PubChem CID: 1923 ChEBI: CHEBI:48981 IUPAC Name: quinolin-8-ol SMILES: OC1=C2N=CC=CC2=CC=C1

PubChem CID 1923
CAS 148-24-3
Molecular Weight (g/mol) 145.16
ChEBI CHEBI:48981
MDL Number MFCD00006807
SMILES OC1=C2N=CC=CC2=CC=C1
Synonym 8-hydroxyquinoline,8-quinolinol,oxyquinoline,oxine,quinophenol,8-quinol,8-oxyquinoline,phenopyridine,oxychinolin,bioquin
IUPAC Name quinolin-8-ol
InChI Key MCJGNVYPOGVAJF-UHFFFAOYSA-N
Molecular Formula C9H7NO
2

3-(2-Thienyl)propanoic acid, 98%

CAS: 5928-51-8 Molecular Formula: C7H8O2S Molecular Weight (g/mol): 156.2 MDL Number: MFCD00047093 InChI Key: MJPVYTKZYZPIQA-UHFFFAOYSA-N Synonym: 3-2-thienyl propanoic acid,3-2-thienyl propionic acid,2-thiophenepropanoic acid,3-thiophen-2-yl propanoic acid,2-thiophenepropionic acid,maybridge3_005592,3-2-thienyl propionic pound inverted question markacid,3-thiophen-2-yl-propionic acid,thiolpropionic acid,pubchem23928 PubChem CID: 703169 IUPAC Name: 3-thiophen-2-ylpropanoic acid SMILES: C1=CSC(=C1)CCC(=O)O

PubChem CID 703169
CAS 5928-51-8
Molecular Weight (g/mol) 156.2
MDL Number MFCD00047093
SMILES C1=CSC(=C1)CCC(=O)O
Synonym 3-2-thienyl propanoic acid,3-2-thienyl propionic acid,2-thiophenepropanoic acid,3-thiophen-2-yl propanoic acid,2-thiophenepropionic acid,maybridge3_005592,3-2-thienyl propionic pound inverted question markacid,3-thiophen-2-yl-propionic acid,thiolpropionic acid,pubchem23928
IUPAC Name 3-thiophen-2-ylpropanoic acid
InChI Key MJPVYTKZYZPIQA-UHFFFAOYSA-N
Molecular Formula C7H8O2S
3

Pyrazinamide, 99%

CAS: 98-96-4 Molecular Formula: C5H5N3O Molecular Weight (g/mol): 123.11 MDL Number: MFCD00006132 InChI Key: IPEHBUMCGVEMRF-UHFFFAOYSA-N Synonym: pyrazinamide,pyrazinecarboxamide,zinamide,pyrazinoic acid amide,2-pyrazinecarboxamide,aldinamide,aldinamid,pirazinamid,pyrazineamide,pyrafat PubChem CID: 1046 ChEBI: CHEBI:45285 IUPAC Name: pyrazine-2-carboxamide SMILES: C1=CN=C(C=N1)C(=O)N

PubChem CID 1046
CAS 98-96-4
Molecular Weight (g/mol) 123.11
ChEBI CHEBI:45285
MDL Number MFCD00006132
SMILES C1=CN=C(C=N1)C(=O)N
Synonym pyrazinamide,pyrazinecarboxamide,zinamide,pyrazinoic acid amide,2-pyrazinecarboxamide,aldinamide,aldinamid,pirazinamid,pyrazineamide,pyrafat
IUPAC Name pyrazine-2-carboxamide
InChI Key IPEHBUMCGVEMRF-UHFFFAOYSA-N
Molecular Formula C5H5N3O
4

1,2-Dimethyl-3-hydroxy-4-pyridone, 98+%

CAS: 30652-11-0 Molecular Formula: C7H9NO2 Molecular Weight (g/mol): 139.15 MDL Number: MFCD00134497 InChI Key: TZXKOCQBRNJULO-UHFFFAOYSA-N Synonym: deferiprone,ferriprox,3-hydroxy-1,2-dimethyl-4 1h-pyridone,3-hydroxy-1,2-dimethylpyridin-4 1h-one,1,2-dimethyl-3-hydroxy-4-pyridone,1,2-dimethyl-3-hydroxypyrid-4-one,1,2-dimethyl-3-hydroxypyridine-4-one,cp20 chelating agent,unii-2bty8kh53l,ferriprox tn PubChem CID: 2972 ChEBI: CHEBI:68554 IUPAC Name: 3-hydroxy-1,2-dimethylpyridin-4-one SMILES: CC1=C(C(=O)C=CN1C)O

PubChem CID 2972
CAS 30652-11-0
Molecular Weight (g/mol) 139.15
ChEBI CHEBI:68554
MDL Number MFCD00134497
SMILES CC1=C(C(=O)C=CN1C)O
Synonym deferiprone,ferriprox,3-hydroxy-1,2-dimethyl-4 1h-pyridone,3-hydroxy-1,2-dimethylpyridin-4 1h-one,1,2-dimethyl-3-hydroxy-4-pyridone,1,2-dimethyl-3-hydroxypyrid-4-one,1,2-dimethyl-3-hydroxypyridine-4-one,cp20 chelating agent,unii-2bty8kh53l,ferriprox tn
IUPAC Name 3-hydroxy-1,2-dimethylpyridin-4-one
InChI Key TZXKOCQBRNJULO-UHFFFAOYSA-N
Molecular Formula C7H9NO2
5

6-Chloro-2-benzoxazolethiol, 99%, Thermo Scientific Chemicals

CAS: 22876-20-6 Molecular Formula: C7H4ClNOS Molecular Weight (g/mol): 185.63 MDL Number: MFCD01456482 InChI Key: HAASPZUBSZGCKU-UHFFFAOYSA-N Synonym: 6-chloro-1,3-benzoxazole-2-thiol,6-chloro-2-mercaptobenzoxazole,6-chloro-2-benzoxazolethiol,6-chlorobenzo d oxazole-2-thiol,2-mercapto-6-chlorobenzoxazole,6-chlorobenzoxazole-2 3h-thione,6-chlorobenzo d oxazole-2 3h-thione,6-chloro-benzooxazole-2-thiol,pubchem8714,6-chlorobenzoxazole-2-thiol PubChem CID: 2119214 IUPAC Name: 6-chloro-3H-1,3-benzoxazole-2-thione SMILES: C1=CC2=C(C=C1Cl)OC(=S)N2

PubChem CID 2119214
CAS 22876-20-6
Molecular Weight (g/mol) 185.63
MDL Number MFCD01456482
SMILES C1=CC2=C(C=C1Cl)OC(=S)N2
Synonym 6-chloro-1,3-benzoxazole-2-thiol,6-chloro-2-mercaptobenzoxazole,6-chloro-2-benzoxazolethiol,6-chlorobenzo d oxazole-2-thiol,2-mercapto-6-chlorobenzoxazole,6-chlorobenzoxazole-2 3h-thione,6-chlorobenzo d oxazole-2 3h-thione,6-chloro-benzooxazole-2-thiol,pubchem8714,6-chlorobenzoxazole-2-thiol
IUPAC Name 6-chloro-3H-1,3-benzoxazole-2-thione
InChI Key HAASPZUBSZGCKU-UHFFFAOYSA-N
Molecular Formula C7H4ClNOS
6

5-Nitrouracil, 99+%, Thermo Scientific™

CAS: 611-08-5 Molecular Formula: C4H3N3O4 Molecular Weight (g/mol): 157.09 MDL Number: MFCD00006021 InChI Key: TUARVSWVPPVUGS-UHFFFAOYSA-N Synonym: 5-nitrouracil,2,4-dihydroxy-5-nitropyrimidine,5-nitropyrimidine-2,4-diol,uracil, 5-nitro,5-nitropyrimidine-2,4 1h,3h-dione,2,4 1h,3h-pyrimidinedione, 5-nitro,5-nitro-1,2,3,4-tetrahydropyrimidine-2,4-dione,4-hydroxy-5-nitropyrimidin-2 1h-one,2,4 1h,3h-pyrimidinedione-5-nitro,5-nitrouracil 2,4-dihydroxy-5-nitropyrimidine PubChem CID: 69135 ChEBI: CHEBI:60763 SMILES: [O-][N+](=O)C1=CNC(=O)NC1=O

PubChem CID 69135
CAS 611-08-5
Molecular Weight (g/mol) 157.09
ChEBI CHEBI:60763
MDL Number MFCD00006021
SMILES [O-][N+](=O)C1=CNC(=O)NC1=O
Synonym 5-nitrouracil,2,4-dihydroxy-5-nitropyrimidine,5-nitropyrimidine-2,4-diol,uracil, 5-nitro,5-nitropyrimidine-2,4 1h,3h-dione,2,4 1h,3h-pyrimidinedione, 5-nitro,5-nitro-1,2,3,4-tetrahydropyrimidine-2,4-dione,4-hydroxy-5-nitropyrimidin-2 1h-one,2,4 1h,3h-pyrimidinedione-5-nitro,5-nitrouracil 2,4-dihydroxy-5-nitropyrimidine
InChI Key TUARVSWVPPVUGS-UHFFFAOYSA-N
Molecular Formula C4H3N3O4
7

1,3-Diphenylisobenzofuran, 97%

CAS: 5471-63-6 Molecular Formula: C20H14O Molecular Weight (g/mol): 270.32 MDL Number: MFCD00005931 InChI Key: ZKSVYBRJSMBDMV-UHFFFAOYSA-N Synonym: 1,3-diphenylisobenzofuran,diphenylisobenzofuran,isobenzofuran, 1,3-diphenyl,1,3 diphenylisobenzofuran,2,5-diphenyl-3,4-benzofuran,acmc-209lj9,1,3-diphenylbenzo c furan,1,3-diphenylisobenzo b furan,1,3-di phenyl-2-benzofuran,# PubChem CID: 21649 IUPAC Name: 1,3-diphenyl-2-benzofuran SMILES: C1=CC=C(C=C1)C2=C3C=CC=CC3=C(O2)C4=CC=CC=C4

PubChem CID 21649
CAS 5471-63-6
Molecular Weight (g/mol) 270.32
MDL Number MFCD00005931
SMILES C1=CC=C(C=C1)C2=C3C=CC=CC3=C(O2)C4=CC=CC=C4
Synonym 1,3-diphenylisobenzofuran,diphenylisobenzofuran,isobenzofuran, 1,3-diphenyl,1,3 diphenylisobenzofuran,2,5-diphenyl-3,4-benzofuran,acmc-209lj9,1,3-diphenylbenzo c furan,1,3-diphenylisobenzo b furan,1,3-di phenyl-2-benzofuran,#
IUPAC Name 1,3-diphenyl-2-benzofuran
InChI Key ZKSVYBRJSMBDMV-UHFFFAOYSA-N
Molecular Formula C20H14O
8

5-Hydroxyindole, 97%

CAS: 1953-54-4 Molecular Formula: C8H7NO Molecular Weight (g/mol): 133.15 MDL Number: MFCD00005677 InChI Key: LMIQERWZRIFWNZ-UHFFFAOYSA-N Synonym: 5-hydroxyindole,indol-5-ol,5-hydroxy-1h-indole,hydroxy-5 indole,5-hydroxy-indole,5-indolol,hydroxy-5-indole,5-hydroxyindol,5-hydroxy indole,unii-320un7xzyn PubChem CID: 16054 IUPAC Name: 1H-indol-5-ol SMILES: OC1=CC=C2NC=CC2=C1

PubChem CID 16054
CAS 1953-54-4
Molecular Weight (g/mol) 133.15
MDL Number MFCD00005677
SMILES OC1=CC=C2NC=CC2=C1
Synonym 5-hydroxyindole,indol-5-ol,5-hydroxy-1h-indole,hydroxy-5 indole,5-hydroxy-indole,5-indolol,hydroxy-5-indole,5-hydroxyindol,5-hydroxy indole,unii-320un7xzyn
IUPAC Name 1H-indol-5-ol
InChI Key LMIQERWZRIFWNZ-UHFFFAOYSA-N
Molecular Formula C8H7NO
9

4-Hydroxyquinoline, 98%

CAS: 611-36-9 Molecular Formula: C9H7NO Molecular Weight (g/mol): 145.16 MDL Number: MFCD00006777,MFCD00956391 InChI Key: PMZDQRJGMBOQBF-UHFFFAOYSA-N Synonym: 4-hydroxyquinoline,quinolin-4-ol,4-quinolinol,quinolin-4 1h-one,4 1h-quinolinone,kynurine,4-hydroxy quinoline,quinoline, 4-hydroxy,ccris 4329,4-chinolinol PubChem CID: 69141 ChEBI: CHEBI:15815 IUPAC Name: 1H-quinolin-4-one SMILES: O=C1C=CNC2=CC=CC=C12

PubChem CID 69141
CAS 611-36-9
Molecular Weight (g/mol) 145.16
ChEBI CHEBI:15815
MDL Number MFCD00006777,MFCD00956391
SMILES O=C1C=CNC2=CC=CC=C12
Synonym 4-hydroxyquinoline,quinolin-4-ol,4-quinolinol,quinolin-4 1h-one,4 1h-quinolinone,kynurine,4-hydroxy quinoline,quinoline, 4-hydroxy,ccris 4329,4-chinolinol
IUPAC Name 1H-quinolin-4-one
InChI Key PMZDQRJGMBOQBF-UHFFFAOYSA-N
Molecular Formula C9H7NO
10

3,5-Dibromopyridine, 98+%

CAS: 625-92-3 Molecular Formula: C5H3Br2N Molecular Weight (g/mol): 236.89 MDL Number: MFCD00014634 InChI Key: SOSPMXMEOFGPIM-UHFFFAOYSA-N Synonym: pyridine, 3,5-dibromo,3,5-dibromo-pyridine,3,5-dibromo pyridine,3,5-dibrompyridin,zlchem 300,3.5-dibromopyridine,3,5-dibromo-pyridin,pubchem2133,3, 5-dibromopyridine,acmc-1auln PubChem CID: 69369 ChEBI: CHEBI:51593 IUPAC Name: 3,5-dibromopyridine SMILES: BrC1=CC(Br)=CN=C1

PubChem CID 69369
CAS 625-92-3
Molecular Weight (g/mol) 236.89
ChEBI CHEBI:51593
MDL Number MFCD00014634
SMILES BrC1=CC(Br)=CN=C1
Synonym pyridine, 3,5-dibromo,3,5-dibromo-pyridine,3,5-dibromo pyridine,3,5-dibrompyridin,zlchem 300,3.5-dibromopyridine,3,5-dibromo-pyridin,pubchem2133,3, 5-dibromopyridine,acmc-1auln
IUPAC Name 3,5-dibromopyridine
InChI Key SOSPMXMEOFGPIM-UHFFFAOYSA-N
Molecular Formula C5H3Br2N
11

Potassium tris(3,5-dimethyl-1-pyrazolyl)borohydride, 99%

CAS: 17567-17-8 Molecular Formula: C15H22BKN6 Molecular Weight (g/mol): 336.29 MDL Number: MFCD00040342 InChI Key: NTWZGFNSHCFHIJ-UHFFFAOYSA-N Synonym: potassium hydrotris 3,5-dimethylpyrazol-1-yl borate,potassium;tris 3,5-dimethylpyrazol-1-yl boron 1-,potassium tri 3,5-dimethyl-1-pyrazolyl borohydride,potassium tris 3,5-dimethyl-1h-pyrazol-1-yl hydrido borate 1- IUPAC Name: potassium tris(3,5-dimethyl-1H-pyrazol-1-yl)boranuide SMILES: [K+].CC1=NN([BH-](N2N=C(C)C=C2C)N2N=C(C)C=C2C)C(C)=C1

CAS 17567-17-8
Molecular Weight (g/mol) 336.29
MDL Number MFCD00040342
SMILES [K+].CC1=NN([BH-](N2N=C(C)C=C2C)N2N=C(C)C=C2C)C(C)=C1
Synonym potassium hydrotris 3,5-dimethylpyrazol-1-yl borate,potassium;tris 3,5-dimethylpyrazol-1-yl boron 1-,potassium tri 3,5-dimethyl-1-pyrazolyl borohydride,potassium tris 3,5-dimethyl-1h-pyrazol-1-yl hydrido borate 1-
IUPAC Name potassium tris(3,5-dimethyl-1H-pyrazol-1-yl)boranuide
InChI Key NTWZGFNSHCFHIJ-UHFFFAOYSA-N
Molecular Formula C15H22BKN6
12

1,10-Phenanthroline monohydrate, ACS reagent

CAS: 5144-89-8 Molecular Formula: C12H10N2O Molecular Weight (g/mol): 198.23 MDL Number: MFCD00149973 InChI Key: PPQJCISYYXZCAE-UHFFFAOYSA-N PubChem CID: 21226 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
InChI Key PPQJCISYYXZCAE-UHFFFAOYSA-N
Molecular Formula C12H10N2O
13

1,10-Phenanthroline monohydrate, 99+%, pure

CAS: 5144-89-8 Molecular Formula: C12H10N2O Molecular Weight (g/mol): 198.23 MDL Number: MFCD00149973 InChI Key: PPQJCISYYXZCAE-UHFFFAOYSA-N PubChem CID: 21226 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
InChI Key PPQJCISYYXZCAE-UHFFFAOYSA-N
Molecular Formula C12H10N2O
14

1H-Benzotriazole, 99%

CAS: 95-14-7 Molecular Formula: C6H5N3 Molecular Weight (g/mol): 119.13 MDL Number: MFCD00005699 InChI Key: QRUDEWIWKLJBPS-UHFFFAOYSA-N Synonym: 1h-benzotriazole,benzotriazole,1,2,3-benzotriazole,1h-benzo d 1,2,3 triazole,azimidobenzene,1h-1,2,3-benzotriazole,aziminobenzene,benztriazole,benzene azimide,benzisotriazole PubChem CID: 7220 ChEBI: CHEBI:75331 IUPAC Name: 2H-benzotriazole SMILES: C1=CC2=NNN=C2C=C1

PubChem CID 7220
CAS 95-14-7
Molecular Weight (g/mol) 119.13
ChEBI CHEBI:75331
MDL Number MFCD00005699
SMILES C1=CC2=NNN=C2C=C1
Synonym 1h-benzotriazole,benzotriazole,1,2,3-benzotriazole,1h-benzo d 1,2,3 triazole,azimidobenzene,1h-1,2,3-benzotriazole,aziminobenzene,benztriazole,benzene azimide,benzisotriazole
IUPAC Name 2H-benzotriazole
InChI Key QRUDEWIWKLJBPS-UHFFFAOYSA-N
Molecular Formula C6H5N3
15

Indazole, 96%

CAS: 271-44-3 Molecular Formula: C7H6N2 Molecular Weight (g/mol): 118.14 InChI Key: BAXOFTOLAUCFNW-UHFFFAOYSA-N Synonym: indazole,1h-benzopyrazole,2-azaindole,isoindazole,2h-indazole,1,2-diazaindene,1,2-benzodiazole,1h-indazol,benzopyrazole,1,2-benzopyrazole PubChem CID: 9221 ChEBI: CHEBI:36669 IUPAC Name: 1H-indazole SMILES: C1=CC=C2C(=C1)C=NN2

PubChem CID 9221
CAS 271-44-3
Molecular Weight (g/mol) 118.14
ChEBI CHEBI:36669
SMILES C1=CC=C2C(=C1)C=NN2
Synonym indazole,1h-benzopyrazole,2-azaindole,isoindazole,2h-indazole,1,2-diazaindene,1,2-benzodiazole,1h-indazol,benzopyrazole,1,2-benzopyrazole
IUPAC Name 1H-indazole
InChI Key BAXOFTOLAUCFNW-UHFFFAOYSA-N
Molecular Formula C7H6N2