Heterocyclic compound

Heterocyclic compounds are a class of organic compounds with cyclic structure. The ring-constituting atoms in the molecule, in addition to carbon, also include one or more nitrogen, sulfur, oxygen and other atoms. Those containing one ring are called single-heterocyclic compounds, such as furan, thiazole, and pyridine. Those containing two or more rings are called fused heterocyclic compounds such as quinoline and purine. The most common and most stable are five- or six-membered heterocyclic ring. Simple heterocyclic ring is capable of merging with benzene or another heterocyclic ring to form a bicyclic, tricyclic or more complex ring system. Some kinds of heterocyclic rings have features of aromatic compounds, such as being easy to participate into substitution reaction, difficult to have addition reaction and being stable to oxidant. Heterocyclic compounds are widely found in nature, such as nucleic acids, most kinds of vitamins, chlorophyll, heme, most kinds of alkaloids, pigments and so on. A fraction of the heterocyclic compounds have aromatic characteristics, such as plants coumarone, jasmonate and animals civetone. There are many synthetic pesticides that belong to such compounds such as herbicides atrazine, amitrole, CMPT, insecticide fluorine propargite, quinoline parathion, thioquinox and so on. Simple heterocyclic compound is an important raw material of organic chemical industry.

The cyclic compounds with atoms constituting the ring system, in addition to carbon atom, also containing O, S, and N heteroatom are collectively referred to as heterocyclic compounds. According to this definition, the cyclic dicarboxylic anhydride, the cyclic imide, lactones, lactides, cyclic anhydrides, lactams, and cyclic ethers, strictly speaking, also belong to heterocyclic compounds. However, due to the nature of these compounds are similar with aliphatic compound, and can easily undergo either the cyclization of the open-chain compounds or ring open reaction to be transformed into chain compounds, thus being generally attributed to the aliphatic chemistry for discussion. Therefore, heterocyclic compounds generally refer specifically to those heterocyclic compounds with relatively stable ring system but different levels of aromatic properties, namely aromatic heterocyclic compound.

The organic heterocyclic compounds belong to a large class in the three large categories of organic compounds, open chain, carbocyclic and heterocyclic organic compounds. It contains various kinds and has a large number accounting for about one-third of all known organic compounds and is also widespread in the biosphere, having close relation with the biological growth, development, reproduction, and genetic variation and so on. Common heterocyclic compounds include furan, thiophene, pyrrole, pyridine, quinoline, carbazole and so on.

These kinds of heterocyclic compounds are widely used in organic synthesis or as pharmaceuticals, pesticides, solvents and so on. They are colorless liquids with special smell or crystallization and have specific gravity being less than or close to water. They are toxic and can be soluble in some organic solvents and slightly soluble in water. In case of fire, heat, oxidants and strong acids, it can cause fire or explosion with simultaneous deposition of toxic sulfur dioxide or nitrogen oxide gas. Furan, when being exposed to the air, is capable of forming peroxides with causing an explosion during distillation. In the management of dangerous goods, according to the risk grades of fire, explosion, toxicity risk, they were classified as flammable liquids, flammable solids and organic toxic chemicals; when used in the reservoir, the first two comply danger of the A and B class while the latter one is based on class C fire danger for conducting fire management. In case of fire, we can use foam, dry powder, water mist, 1211 and carbon dioxide for fire extinguishing agents.

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Structure Chemical Name CAS MF
5,6-diMethoxybenzo[c]isoxazole 5,6-diMethoxybenzo[c]isoxazole 148495-00-5 C9H9NO3
tert-butyl 8-oxo-3-azabicyclo[3.2.1]octane-3-carboxylate tert-butyl 8-oxo-3-azabicyclo[3.2.1]octane-3-carboxylate 637301-19-0 C12H19NO3
bk-DMBDB (hydrochloride) bk-DMBDB (hydrochloride) 17763-12-1 C13H18ClNO3
6-Chloro-5-hydroxy-nicotinic acid methyl ester 6-Chloro-5-hydroxy-nicotinic acid methyl ester 915107-30-1 C7H6ClNO3
Estra-1,3,5(10)-triene-3,17-diol,7-[9-[(4,4,5,5,5-pentafluoropentyl)thio]nonyl]-,17-acetate,(7a,17b)- Estra-1,3,5(10)-triene-3,17-diol,7-[9-[(4,4,5,5,5-pentafluoropentyl)thio]nonyl]-,17-acetate,(7a,17b)- 875573-69-6 C34H49F5O3S
6-Bromo-5-fluoro-2-pyridinecarboxylic acid 6-Bromo-5-fluoro-2-pyridinecarboxylic acid 1052714-46-1 C6H3BrFNO2
5-Fluoro-1H-pyrrolo[2,3-b]pyridine-3-carbaldehyde 5-Fluoro-1H-pyrrolo[2,3-b]pyridine-3-carbaldehyde 1171920-17-4 C8H5FN2O
2-Hydroxy-6-methyl-pyrimidine-4-carboxylic acidhydrochloride 2-Hydroxy-6-methyl-pyrimidine-4-carboxylic acidhydrochloride 1185300-30-4 C6H7ClN2O3
5-Methyl-1H-hexahydropyrrolo[3,4-b]pyrrole 5-Methyl-1H-hexahydropyrrolo[3,4-b]pyrrole 132414-59-6 C7H14N2
coccinelline coccinelline 34290-97-6 C13H23NO
(+)-(4S)-PHENYL-ALPHA-[(4S)-PHENYLOXAZOLIDIN-2-YLIDENE]-2-OXAZOLINE-2-ACETONITRILE (+)-(4S)-PHENYL-ALPHA-[(4S)-PHENYLOXAZOLIDIN-2-YLIDENE]-2-OXAZOLINE-2-ACETONITRILE 150639-33-1 C20H17N3O2
4-Chloro-N-methylpiperidine 4-Chloro-N-methylpiperidine 5570-77-4 C6H12ClN
1H-Pyrazole-5-carboxamide, N-[(1S)-2,2-dicyclopropyl-1-[[[4-[(1S,2R)-3-[(3R)-3,4-dimethyl-1-piperazinyl]-2-[[(2S)-2-methoxy-1-oxopropyl]amino]-1-methyl-3-oxopropyl]-2-fluorophenyl]amino]carbonyl]ethyl]-1-ethyl- 1H-Pyrazole-5-carboxamide, N-[(1S)-2,2-dicyclopropyl-1-[[[4-[(1S,2R)-3-[(3R)-3,4-dimethyl-1-piperazinyl]-2-[[(2S)-2-methoxy-1-oxopropyl]amino]-1-methyl-3-oxopropyl]-2-fluorophenyl]amino]carbonyl]ethyl]-1-ethyl- 2978700-29-5 C35H50FN7O5
Antiproliferative agent-71 Antiproliferative agent-71 3083307-42-7 C50H54N10O5S
2,3-Diaminobenzoic acid 2,3-Diaminobenzoic acid 603-81-6 C7H8N2O2
4,6-Dimethyl-2-methylsulfonylpyrimidine 4,6-Dimethyl-2-methylsulfonylpyrimidine 35144-22-0 C7H10N2O2S
2-Amino-5-nitrothiazole 2-Amino-5-nitrothiazole 121-66-4 C3H3N3O2S
Benzo[d]Isothiazole Benzo[d]Isothiazole 272-16-2 C7H5NS
3-BROMO-1H-PYRROLO[2,3-C]PYRIDINE 3-BROMO-1H-PYRROLO[2,3-C]PYRIDINE 67058-76-8 C7H5BrN2
2,1-BENZISOXAZOLE 2,1-BENZISOXAZOLE 271-58-9 C7H5NO
5-BROMO-6-METHYL INDOLE 5-BROMO-6-METHYL INDOLE 1000343-13-4 C9H8BrN
6-BROMO-5-METHYLINDOLE 6-BROMO-5-METHYLINDOLE 248602-16-6 C9H8BrN
6-BROMO-5-METHYL (1H)INDAZOLE 6-BROMO-5-METHYL (1H)INDAZOLE 1000343-69-0 C8H7BrN2
2-chloro-4-(2,2-dimethylpropyl)pyridine 2-chloro-4-(2,2-dimethylpropyl)pyridine 2387538-18-1 C10H14ClN
Pyrido[2,3-d]pyrimidin-4(3H)-one, 2-chloro- Pyrido[2,3-d]pyrimidin-4(3H)-one, 2-chloro- 93049-38-8 C7H4ClN3O
Ethanone, 1-[4-(3-aminocyclohexyl)-1-piperazinyl]- Ethanone, 1-[4-(3-aminocyclohexyl)-1-piperazinyl]- 1517686-56-4 C12H23N3O
(R)-2-(2,5-DIFLUOROPHENYL)PYRROLIDINE HYDROCHLORIDE (R)-2-(2,5-DIFLUOROPHENYL)PYRROLIDINE HYDROCHLORIDE 1218935-60-4 C10H12ClF2N
4,5-diiodo-1-methyl-triazole 4,5-diiodo-1-methyl-triazole 1248676-71-2 C3H3I2N3
4H-Pyrrolo[3,2-d]pyrimidin-4-one, 2-chloro-3,5-dihydro-3-methyl- 4H-Pyrrolo[3,2-d]pyrimidin-4-one, 2-chloro-3,5-dihydro-3-methyl- 2351929-82-1 C7H6ClN3O
3H-Pyrazolo[4,3-f]isoquinoline, 6-(5-bromo-2-pyridinyl)-6,7,8,9-tetrahydro-8-methyl-7-(2,2,2-trifluoroethyl)-, (6S,8R)- 3H-Pyrazolo[4,3-f]isoquinoline, 6-(5-bromo-2-pyridinyl)-6,7,8,9-tetrahydro-8-methyl-7-(2,2,2-trifluoroethyl)-, (6S,8R)- 2142634-01-1 C18H16BrF3N4
1-CYCLOPROPYLMETHYL-PIPERAZINE DIHYDROCHLORIDE 1-CYCLOPROPYLMETHYL-PIPERAZINE DIHYDROCHLORIDE 373608-42-5 C8H18Cl2N2
2-[[(2'-Cyano[1,1'-biphenyl]-4-yl)methyl]amino]-3-nitro-benzoic acid ethyl ester 2-[[(2'-Cyano[1,1'-biphenyl]-4-yl)methyl]amino]-3-nitro-benzoic acid ethyl ester 136285-67-1 C23H19N3O4
2-butyl-benzimidazol 2-butyl-benzimidazol 5851-44-5 C11H14N2
2-Propenal, 3-(5-nitro-2-thienyl)- 2-Propenal, 3-(5-nitro-2-thienyl)- 62391-19-9 C7H5NO3S
allyl chlorooxoacetate allyl chlorooxoacetate 74503-07-4 C5H5ClO3
Benzenamine, 4,4',4''-(2,4,6-pyrimidinetriyl)tris- (9CI) Benzenamine, 4,4',4''-(2,4,6-pyrimidinetriyl)tris- (9CI) 136009-19-3 C22H19N5
α-(4-Bromophenyl)-2-pyridinemethanol α-(4-Bromophenyl)-2-pyridinemethanol 848605-31-2 C12H10BrNO
Methyl 1-[(2'-cyanobiphenyl-4-yl)methyl]-2-ethoxy-1H-benzimidazole-7-carboxylate Methyl 1-[(2'-cyanobiphenyl-4-yl)methyl]-2-ethoxy-1H-benzimidazole-7-carboxylate 139481-44-0 C25H21N3O3
6-(Bromomethyl)-2,4-pteridinediamine hydrobromide 6-(Bromomethyl)-2,4-pteridinediamine hydrobromide 52853-40-4 C7H8Br2N6
5-(1-Hydroxyethylidene)-2,2-dimethyl-1,3-dioxane-4,6-dione 5-(1-Hydroxyethylidene)-2,2-dimethyl-1,3-dioxane-4,6-dione 85920-63-4 C8H10O5
3-(4-Nitro-1-oxo-1,3-dihydroisoindol-2-yl)piperidine-2,6-dione 3-(4-Nitro-1-oxo-1,3-dihydroisoindol-2-yl)piperidine-2,6-dione 827026-45-9 C13H11N3O5
7H-Pyrrolo[2,3-d]pyrimidine, 2-methyl- (7CI) 7H-Pyrrolo[2,3-d]pyrimidine, 2-methyl- (7CI) 89792-07-4 C7H7N3
Pneumocandin B0 Pneumocandin B0 135575-42-7 C50H80N8O17
Latanoprost Lactone Diol Latanoprost Lactone Diol 145667-75-0 C18H24O4
2-Propenoic acid, 3-[1-[5-O-[bis(4-methoxyphenyl)phenylmethyl]-2-deoxy-β-D-erythro-pentofuranosyl]-1,2,3,4-tetrahydro-2,4-dioxo-5-pyrimidinyl]-, (2E)- 2-Propenoic acid, 3-[1-[5-O-[bis(4-methoxyphenyl)phenylmethyl]-2-deoxy-β-D-erythro-pentofuranosyl]-1,2,3,4-tetrahydro-2,4-dioxo-5-pyrimidinyl]-, (2E)- 923023-62-5 C33H32N2O9
1H-PYRROLO[3,2-B]PYRIDIN-6-AMINE 1H-PYRROLO[3,2-B]PYRIDIN-6-AMINE 1015609-67-2 C7H7N3
Lenacapavir Intermediate Lenacapavir Intermediate 2375020-19-0 C29H24BrF7N4O3S
HFPO OLIGOMER ACID FLUORIDES HFPO OLIGOMER ACID FLUORIDES 65208-35-7 C6F12O2
4-Fluoro-1H-indole-7-carbonitrile 4-Fluoro-1H-indole-7-carbonitrile 313337-33-6 C9H5FN2
2-HYDROXYETHYLUREA 2-HYDROXYETHYLUREA 2078-71-9 C3H8N2O2
(2R,3S)-2-((R)-1-(3,5-Bis(trifluoromethyl)phenyl)ethoxy)-3-(4-fluorophenyl)morpholine hydrochloride (2R,3S)-2-((R)-1-(3,5-Bis(trifluoromethyl)phenyl)ethoxy)-3-(4-fluorophenyl)morpholine hydrochloride 171482-05-6 C20H19ClF7NO2
7,8,9,10-Tetrahydro-8-(trifluoroacetyl)-6,10-methano-6H-pyrazino[2,3-h][3]benzazepine (N-(Trifluoroacetyl)varenicline) 7,8,9,10-Tetrahydro-8-(trifluoroacetyl)-6,10-methano-6H-pyrazino[2,3-h][3]benzazepine (N-(Trifluoroacetyl)varenicline) 230615-70-0 C15H12F3N3O
6-BOC-3,6-DIAZABICYCLO[3.2.0]HEPTANE 6-BOC-3,6-DIAZABICYCLO[3.2.0]HEPTANE 122848-57-1 C10H18N2O2
1-BENZYL-PYRROLIDINE-3-CARBONITRILE 1-BENZYL-PYRROLIDINE-3-CARBONITRILE 10603-52-8 C12H14N2
1-(4-(3-Methoxy-4-nitrophenyl)piperazin-1-yl)ethanone 1-(4-(3-Methoxy-4-nitrophenyl)piperazin-1-yl)ethanone 1116229-11-8 C13H17N3O4
Amorolfine EP Impurity A Amorolfine EP Impurity A 78613-39-5 C21H35NO2
3-(Benzyloxy)-4-oxo-4h-pyran-2-carboxylic acid 3-(Benzyloxy)-4-oxo-4h-pyran-2-carboxylic acid 119736-16-2 C13H10O5
SELEXIPAG interMediate SELEXIPAG interMediate 475086-75-0 C23H27N3O
2-PhenylpyriMidine-4-carboxylic acid 2-PhenylpyriMidine-4-carboxylic acid 16879-53-1 C11H8N2O2
Ethyl 2-chloropyrazolo[1,5-a]pyriMidine-3-carboxylate Ethyl 2-chloropyrazolo[1,5-a]pyriMidine-3-carboxylate 1394003-65-6 C9H8ClN3O2
Pyrazolam Pyrazolam 39243-02-2 C16H12BrN5
4-(1-Fluoro-1-methyl-ethyl)-pyrimidine-5-carbaldehyde 4-(1-Fluoro-1-methyl-ethyl)-pyrimidine-5-carbaldehyde 1427195-14-9 C8H9FN2O
4-(3-(allyloxymethyl)phenyl)-2-chloropyrimidine 4-(3-(allyloxymethyl)phenyl)-2-chloropyrimidine 937273-29-5 C14H13ClN2O
tert-Butyl 2,8-diazaspiro[4.5]decane-2-carboxylate tert-Butyl 2,8-diazaspiro[4.5]decane-2-carboxylate 336191-17-4 C13H24N2O2
2,8-Bis(diphenylphosphoryl)dibenzo[b,d]thiophene 2,8-Bis(diphenylphosphoryl)dibenzo[b,d]thiophene 1019842-99-9 C36H26O2P2S
2-(tert-butoxycarbonyl)-5,7-dichloro-1,2,3,4-tetrahydroisoquinoline-6-carboxylic acid 2-(tert-butoxycarbonyl)-5,7-dichloro-1,2,3,4-tetrahydroisoquinoline-6-carboxylic acid 851784-82-2 C15H17Cl2NO4
Pyridine, 4-[5-(4-pyridinyl)-1H-1,2,4-triazol-3-yl]-, 1-oxide Pyridine, 4-[5-(4-pyridinyl)-1H-1,2,4-triazol-3-yl]-, 1-oxide 36770-53-3 C12H9N5O
trans-2,5-Bis(methoxymethyl)pyrrolidine trans-2,5-Bis(methoxymethyl)pyrrolidine 144993-81-7 C8H17NO2
5-(4-BROMO-PHENYL)-CYCLOHEXANE-1,3-DIONE 5-(4-BROMO-PHENYL)-CYCLOHEXANE-1,3-DIONE 239132-48-0 C12H11BrO2
(6R,7R)-7-AMINO-8-OXO-3-((2S)-TETRAHYDROFURAN-2-YL)-5-THIA-1-AZABICYCLO[4.2.0]OCT-2-ENE-2-CARBOXYLIC ACID 4-NITROBENZYL ESTER HCL (6R,7R)-7-AMINO-8-OXO-3-((2S)-TETRAHYDROFURAN-2-YL)-5-THIA-1-AZABICYCLO[4.2.0]OCT-2-ENE-2-CARBOXYLIC ACID 4-NITROBENZYL ESTER HCL 655233-39-9 C18H20ClN3O6S
methyl 8-boc-8-azabicyclo[3.2.1]octane-2-carboxylate methyl 8-boc-8-azabicyclo[3.2.1]octane-2-carboxylate 1033820-28-8 C14H23NO4
2,5-Piperazinedione, 1-acetyl-3-(phenylmethylene)-, (3Z)- 2,5-Piperazinedione, 1-acetyl-3-(phenylmethylene)-, (3Z)- 30166-30-4 C13H12N2O3
3,5-Dibromo-1H-pyrazole 3,5-Dibromo-1H-pyrazole 67460-86-0 C3H2Br2N2
2-cyanoethyl 4-(4-cyano-2-methoxyphenyl)-2,8-dimethyl-5-oxo-1,4,5,6-tetrahydro-1,6-naphthyridine-3-carboxylate 2-cyanoethyl 4-(4-cyano-2-methoxyphenyl)-2,8-dimethyl-5-oxo-1,4,5,6-tetrahydro-1,6-naphthyridine-3-carboxylate 1050477-43-4 C22H20N4O4
MK-4618 Pyrimidinone Acid Sodium Salt MK-4618 Pyrimidinone Acid Sodium Salt 1421271-01-3 C8H9N2NaO3
4,6-Dibromo-pyrazolo[1,5-a]pyridine-3-carbonitrile 4,6-Dibromo-pyrazolo[1,5-a]pyridine-3-carbonitrile 2068065-63-2 C8H3Br2N3
4-Pyrimidinamine, 2-chloro-N-[2-[(1-methylethyl)sulfonyl]phenyl]- 4-Pyrimidinamine, 2-chloro-N-[2-[(1-methylethyl)sulfonyl]phenyl]- 1197956-18-5 C13H14ClN3O2S
6-Fluoro-1-methyl-1H-indole-2-carboxylic acid 6-Fluoro-1-methyl-1H-indole-2-carboxylic acid 893731-12-9 C10H8FNO2
3-Bromo-11,11-dimethyl-11H-benzo[b]fluorene 3-Bromo-11,11-dimethyl-11H-benzo[b]fluorene 1674334-59-8 C19H15Br
3-Iodo-1-(1-methyl-piperidin-4-ylmethyl)-1H-pyrazolo[3,4-d]pyrimidin-4-ylamine 3-Iodo-1-(1-methyl-piperidin-4-ylmethyl)-1H-pyrazolo[3,4-d]pyrimidin-4-ylamine 1411763-96-6 C12H17IN6
1-AZASPIRO[3.3]HEPTANE HEMIOXALATE 1-AZASPIRO[3.3]HEPTANE HEMIOXALATE 1523571-15-4 C8H13NO4
O-304 O-304 1261289-04-6 C16H11Cl2N3O2S
N-(4-Oxocyclohexyl)acetamide N-(4-Oxocyclohexyl)acetamide 27514-08-5 C8H13NO2
(S)-1-BOC-2-METHYL-[1,4]DIAZEPANE (S)-1-BOC-2-METHYL-[1,4]DIAZEPANE 194032-32-1 C11H22N2O2
2-(3,5-Dichlorophenyl)Pyrrolidine 2-(3,5-Dichlorophenyl)Pyrrolidine 887344-13-0 C10H11Cl2N
5'-O-DMT-2'-O-propynyluridine 3'-CE phosphoramidite 5'-O-DMT-2'-O-propynyluridine 3'-CE phosphoramidite 171486-62-7 C42H49N4O9P
3-Ethynyl-1-(1-methylethyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine 3-Ethynyl-1-(1-methylethyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine 1189793-01-8 C10H11N5
5-CHLORO-1H-BENZOIMIDAZOL-2-OL 5-CHLORO-1H-BENZOIMIDAZOL-2-OL 2034-23-3 C7H5ClN2O
4-Acetoxyindole 4-Acetoxyindole 5585-96-6 C10H9NO2
4-(2-{[6-(4-methoxyphenoxy)pyrimidin-4-yl]methylamino}ethoxy)benzaldehyde 4-(2-{[6-(4-methoxyphenoxy)pyrimidin-4-yl]methylamino}ethoxy)benzaldehyde 607723-87-5 C21H21N3O4
N'-Hydroxy-2-(pyrrolidin-1-yl)benzimidamide N'-Hydroxy-2-(pyrrolidin-1-yl)benzimidamide C11H15N3O
6-Bromo-4-hydroxy-pyrazolo[1,5-a]pyridine-3-carbonitrile 6-Bromo-4-hydroxy-pyrazolo[1,5-a]pyridine-3-carbonitrile 2068065-16-5 C8H4BrN3O
2,4,8,10-Tetraoxa-3,9-dithiaspiro[5.5]undecane, 3,3,9,9-tetraoxide 2,4,8,10-Tetraoxa-3,9-dithiaspiro[5.5]undecane, 3,3,9,9-tetraoxide 201419-80-9 C5H8O8S2
Pd-PEPPSI-IHeptCl Pd-PEPPSI-IHeptCl 1814936-54-3 C48H70Cl5N3Pd
(R)-2-((trifluoromethoxy)methyl)piperazine (R)-2-((trifluoromethoxy)methyl)piperazine
N6-[(5-Bromothien-2-yl)methyl]adenosine N6-[(5-Bromothien-2-yl)methyl]adenosine 1706525-09-8 C15H16BrN5O4S
Pyrido[2,3-b]pyrazine-2,3-dione, 6-bromo-1,4-dihydro- Pyrido[2,3-b]pyrazine-2,3-dione, 6-bromo-1,4-dihydro- 1429377-72-9 C7H4BrN3O2
4-Bromo-1-chloroisoquinoline 4-Bromo-1-chloroisoquinoline 66728-98-1 C9H5BrClN
3-HYDROXY-1-N-CBZ-PYRROLIDINE 3-HYDROXY-1-N-CBZ-PYRROLIDINE 95656-88-5 C12H15NO3
2,4-DICHLOROQUINOLINE 2,4-DICHLOROQUINOLINE 703-61-7 C9H5Cl2N
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