Organoheterocyclic compounds
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2-Ethylimidazole, 99%
CAS: 1072-62-4 Molecular Formula: C5H8N2 Molecular Weight (g/mol): 96.13 MDL Number: MFCD00005192 InChI Key: PQAMFDRRWURCFQ-UHFFFAOYSA-N Synonym: 2-ethylimidazole,1h-imidazole, 2-ethyl,imidazole, 2-ethyl,2-ethylimidazole 98+%,2ez,2-ethylimdazole,2-ethyl imidazole,2-ethyl-imidazole,pubchem15972 PubChem CID: 66130 IUPAC Name: 2-ethyl-1H-imidazole SMILES: CCC1=NC=CN1
| PubChem CID | 66130 |
|---|---|
| CAS | 1072-62-4 |
| Molecular Weight (g/mol) | 96.13 |
| MDL Number | MFCD00005192 |
| SMILES | CCC1=NC=CN1 |
| Synonym | 2-ethylimidazole,1h-imidazole, 2-ethyl,imidazole, 2-ethyl,2-ethylimidazole 98+%,2ez,2-ethylimdazole,2-ethyl imidazole,2-ethyl-imidazole,pubchem15972 |
| IUPAC Name | 2-ethyl-1H-imidazole |
| InChI Key | PQAMFDRRWURCFQ-UHFFFAOYSA-N |
| Molecular Formula | C5H8N2 |
5-Chloropyrimidine, 95%
CAS: 17180-94-8 Molecular Formula: C4H3ClN2 Molecular Weight (g/mol): 114.53 MDL Number: MFCD03840717 InChI Key: ZLNPDTOTEVIMMY-UHFFFAOYSA-N Synonym: pyrimidine, 5-chloro,5-chloro-pyrimidine,5-choloropyrimidine,5-chloranylpyrimidine,pubchem7041,pyrimidine, 5-chloro-6ci,8ci,9ci PubChem CID: 12600384 IUPAC Name: 5-chloropyrimidine SMILES: ClC1=CN=CN=C1
| PubChem CID | 12600384 |
|---|---|
| CAS | 17180-94-8 |
| Molecular Weight (g/mol) | 114.53 |
| MDL Number | MFCD03840717 |
| SMILES | ClC1=CN=CN=C1 |
| Synonym | pyrimidine, 5-chloro,5-chloro-pyrimidine,5-choloropyrimidine,5-chloranylpyrimidine,pubchem7041,pyrimidine, 5-chloro-6ci,8ci,9ci |
| IUPAC Name | 5-chloropyrimidine |
| InChI Key | ZLNPDTOTEVIMMY-UHFFFAOYSA-N |
| Molecular Formula | C4H3ClN2 |
3,5-Dimethylpyrazole, 99%
CAS: 67-51-6 Molecular Formula: C5H8N2 Molecular Weight (g/mol): 96.13 MDL Number: MFCD00005243 InChI Key: SDXAWLJRERMRKF-UHFFFAOYSA-N Synonym: 3,5-dimethylpyrazole,1h-pyrazole, 3,5-dimethyl,3,5 dmp,pyrazole, 3,5-dimethyl,3,5-dwumetylopirazolu,unii-h21n865k9j,3,5-dwumetylopirazolu polish,3,5-dimethyl pyrazole,pyrazole,5-dimethyl,pubchem13256 PubChem CID: 6210 IUPAC Name: 3,5-dimethyl-1H-pyrazole SMILES: CC1=CC(C)=NN1
| PubChem CID | 6210 |
|---|---|
| CAS | 67-51-6 |
| Molecular Weight (g/mol) | 96.13 |
| MDL Number | MFCD00005243 |
| SMILES | CC1=CC(C)=NN1 |
| Synonym | 3,5-dimethylpyrazole,1h-pyrazole, 3,5-dimethyl,3,5 dmp,pyrazole, 3,5-dimethyl,3,5-dwumetylopirazolu,unii-h21n865k9j,3,5-dwumetylopirazolu polish,3,5-dimethyl pyrazole,pyrazole,5-dimethyl,pubchem13256 |
| IUPAC Name | 3,5-dimethyl-1H-pyrazole |
| InChI Key | SDXAWLJRERMRKF-UHFFFAOYSA-N |
| Molecular Formula | C5H8N2 |
Phenazine, 99+%
CAS: 92-82-0 Molecular Formula: C12H8N2 Molecular Weight (g/mol): 180.21 MDL Number: MFCD00005023 InChI Key: PCNDJXKNXGMECE-UHFFFAOYSA-N Synonym: dibenzopyrazine,azophenylene,dibenzoparadiazine,acridizine,9,10-diazaanthracene,dibenzo-p-diazine,unii-2jhr6k463w,phenazine,dibenzo b,e pyrazine,acmc-209rhs PubChem CID: 4757 ChEBI: CHEBI:36674 IUPAC Name: phenazine SMILES: C1=CC=C2C(=C1)N=C3C=CC=CC3=N2
| PubChem CID | 4757 |
|---|---|
| CAS | 92-82-0 |
| Molecular Weight (g/mol) | 180.21 |
| ChEBI | CHEBI:36674 |
| MDL Number | MFCD00005023 |
| SMILES | C1=CC=C2C(=C1)N=C3C=CC=CC3=N2 |
| Synonym | dibenzopyrazine,azophenylene,dibenzoparadiazine,acridizine,9,10-diazaanthracene,dibenzo-p-diazine,unii-2jhr6k463w,phenazine,dibenzo b,e pyrazine,acmc-209rhs |
| IUPAC Name | phenazine |
| InChI Key | PCNDJXKNXGMECE-UHFFFAOYSA-N |
| Molecular Formula | C12H8N2 |
2-Bromopyridine, 99%
CAS: 109-04-6 Molecular Formula: C5H4BrN Molecular Weight (g/mol): 157.998 MDL Number: MFCD00006219 InChI Key: IMRWILPUOVGIMU-UHFFFAOYSA-N Synonym: o-bromopyridine,pyridine, 2-bromo,2-bromo-pyridine,2-pyridyl bromide,alpha-bromopyridine,beta-bromopyridine,bromopyridine,2-bromopyridin,2-bromo pyridine,unii-7z7mlc4vd8 PubChem CID: 7973 ChEBI: CHEBI:51574 IUPAC Name: 2-bromopyridine SMILES: C1=CC=NC(=C1)Br
| PubChem CID | 7973 |
|---|---|
| CAS | 109-04-6 |
| Molecular Weight (g/mol) | 157.998 |
| ChEBI | CHEBI:51574 |
| MDL Number | MFCD00006219 |
| SMILES | C1=CC=NC(=C1)Br |
| Synonym | o-bromopyridine,pyridine, 2-bromo,2-bromo-pyridine,2-pyridyl bromide,alpha-bromopyridine,beta-bromopyridine,bromopyridine,2-bromopyridin,2-bromo pyridine,unii-7z7mlc4vd8 |
| IUPAC Name | 2-bromopyridine |
| InChI Key | IMRWILPUOVGIMU-UHFFFAOYSA-N |
| Molecular Formula | C5H4BrN |
Phenothiazine 98.0+%, TCI America™
CAS: 92-84-2 Molecular Formula: C12H9NS Molecular Weight (g/mol): 199.271 MDL Number: MFCD00005015 InChI Key: WJFKNYWRSNBZNX-UHFFFAOYSA-N Synonym: phenothiazine,thiodiphenylamine,feeno,dibenzothiazine,phenosan,phenthiazine,dibenzo-1,4-thiazine,penthazine,souframine,agrazine PubChem CID: 7108 ChEBI: CHEBI:37931 IUPAC Name: 10H-phenothiazine SMILES: C1=CC=C2C(=C1)NC3=CC=CC=C3S2
| PubChem CID | 7108 |
|---|---|
| CAS | 92-84-2 |
| Molecular Weight (g/mol) | 199.271 |
| ChEBI | CHEBI:37931 |
| MDL Number | MFCD00005015 |
| SMILES | C1=CC=C2C(=C1)NC3=CC=CC=C3S2 |
| Synonym | phenothiazine,thiodiphenylamine,feeno,dibenzothiazine,phenosan,phenthiazine,dibenzo-1,4-thiazine,penthazine,souframine,agrazine |
| IUPAC Name | 10H-phenothiazine |
| InChI Key | WJFKNYWRSNBZNX-UHFFFAOYSA-N |
| Molecular Formula | C12H9NS |
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 |
gamma-Valerolactone, 98%
CAS: 108-29-2 Molecular Formula: C5H8O2 Molecular Weight (g/mol): 100.12 MDL Number: MFCD00005400 InChI Key: GAEKPEKOJKCEMS-UHFFFAOYSA-N Synonym: gamma-valerolactone,4-valerolactone,4-pentanolide,5-methyldihydrofuran-2 3h-one,4-hydroxypentanoic acid lactone,gamma-pentalactone,4-hydroxyvaleric acid lactone,2 3h-furanone, dihydro-5-methyl,4-methyl-gamma-butyrolactone,pentanolide-1,4 PubChem CID: 7921 ChEBI: CHEBI:48569 IUPAC Name: 5-methyloxolan-2-one SMILES: CC1CCC(=O)O1
| PubChem CID | 7921 |
|---|---|
| CAS | 108-29-2 |
| Molecular Weight (g/mol) | 100.12 |
| ChEBI | CHEBI:48569 |
| MDL Number | MFCD00005400 |
| SMILES | CC1CCC(=O)O1 |
| Synonym | gamma-valerolactone,4-valerolactone,4-pentanolide,5-methyldihydrofuran-2 3h-one,4-hydroxypentanoic acid lactone,gamma-pentalactone,4-hydroxyvaleric acid lactone,2 3h-furanone, dihydro-5-methyl,4-methyl-gamma-butyrolactone,pentanolide-1,4 |
| IUPAC Name | 5-methyloxolan-2-one |
| InChI Key | GAEKPEKOJKCEMS-UHFFFAOYSA-N |
| Molecular Formula | C5H8O2 |
1H-Benzotriazol-1-yloxytri(1-pyrrolidinyl)phosphonium hexafluorophosphate, 98%
CAS: 128625-52-5 Molecular Formula: C18H28F6N6OP2 Molecular Weight (g/mol): 520.401 MDL Number: MFCD00077411 InChI Key: VIAFLMPQBHAMLI-UHFFFAOYSA-N Synonym: pybop,1h-benzo d 1,2,3 triazol-1-yl oxy tri pyrrolidin-1-yl phosphonium hexafluorophosphate v,benzotriazol-1-yloxy tripyrrolidinophosphonium hexafluorophosphate,benzotriazole-1-yl-oxytripyrrolidinophosphonium hexafluorophosphate,benzotriazol-1-yl-oxytripyrrolidinophosphonium hexafluorophosphate,1h-benzotriazol-1-yloxytripyrrolidinophosphonium hexafluorophosphate,benzotriazol-1-yloxytris pyrrolidino phosphonium hexafluorophosphate,benzotriazole-1-yl-oxy-tris-pyrrolidino-phosphonium hexafluorophosphate,benzotriazol-1-yl-oxy-tripyrrolidinophosphonium hexafluorophosphate,benzotriazol-1-yl-oxytripyrrolidinphosphonium hexafluorophosphate PubChem CID: 2724699 IUPAC Name: benzotriazol-1-yloxy(tripyrrolidin-1-yl)phosphanium;hexafluorophosphate SMILES: C1CCN(C1)[P+](N2CCCC2)(N3CCCC3)ON4C5=CC=CC=C5N=N4.F[P-](F)(F)(F)(F)F
| PubChem CID | 2724699 |
|---|---|
| CAS | 128625-52-5 |
| Molecular Weight (g/mol) | 520.401 |
| MDL Number | MFCD00077411 |
| SMILES | C1CCN(C1)[P+](N2CCCC2)(N3CCCC3)ON4C5=CC=CC=C5N=N4.F[P-](F)(F)(F)(F)F |
| Synonym | pybop,1h-benzo d 1,2,3 triazol-1-yl oxy tri pyrrolidin-1-yl phosphonium hexafluorophosphate v,benzotriazol-1-yloxy tripyrrolidinophosphonium hexafluorophosphate,benzotriazole-1-yl-oxytripyrrolidinophosphonium hexafluorophosphate,benzotriazol-1-yl-oxytripyrrolidinophosphonium hexafluorophosphate,1h-benzotriazol-1-yloxytripyrrolidinophosphonium hexafluorophosphate,benzotriazol-1-yloxytris pyrrolidino phosphonium hexafluorophosphate,benzotriazole-1-yl-oxy-tris-pyrrolidino-phosphonium hexafluorophosphate,benzotriazol-1-yl-oxy-tripyrrolidinophosphonium hexafluorophosphate,benzotriazol-1-yl-oxytripyrrolidinphosphonium hexafluorophosphate |
| IUPAC Name | benzotriazol-1-yloxy(tripyrrolidin-1-yl)phosphanium;hexafluorophosphate |
| InChI Key | VIAFLMPQBHAMLI-UHFFFAOYSA-N |
| Molecular Formula | C18H28F6N6OP2 |
o-Cresolphthalein
CAS: 596-27-0 Molecular Formula: C22H18O4 Molecular Weight (g/mol): 346.38 MDL Number: MFCD00005912 InChI Key: CPBJMKMKNCRKQB-UHFFFAOYSA-N Synonym: o-cresolphthalein,cresolphthalein,3,3'-dimethylphenolphthalein,1 3h-isobenzofuranone, 3,3-bis 4-hydroxy-3-methylphenyl,3',3-dimethylphenolphthalein,o-cresolphalein,3,3-bis 4-hydroxy-3-methylphenyl isobenzofuran-1 3h-one,unii-xou2d9049g,phenolphthalein, 3',3-dimethyl,3,3-bis 4-hydroxy-m-tolyl phthalide PubChem CID: 68995 SMILES: CC1=CC(=CC=C1O)C1(OC(=O)C2=CC=CC=C12)C1=CC=C(O)C(C)=C1
| PubChem CID | 68995 |
|---|---|
| CAS | 596-27-0 |
| Molecular Weight (g/mol) | 346.38 |
| MDL Number | MFCD00005912 |
| SMILES | CC1=CC(=CC=C1O)C1(OC(=O)C2=CC=CC=C12)C1=CC=C(O)C(C)=C1 |
| Synonym | o-cresolphthalein,cresolphthalein,3,3'-dimethylphenolphthalein,1 3h-isobenzofuranone, 3,3-bis 4-hydroxy-3-methylphenyl,3',3-dimethylphenolphthalein,o-cresolphalein,3,3-bis 4-hydroxy-3-methylphenyl isobenzofuran-1 3h-one,unii-xou2d9049g,phenolphthalein, 3',3-dimethyl,3,3-bis 4-hydroxy-m-tolyl phthalide |
| InChI Key | CPBJMKMKNCRKQB-UHFFFAOYSA-N |
| Molecular Formula | C22H18O4 |
Aniracetam
CAS: 72432-10-1 Molecular Formula: C12H13NO3 Molecular Weight (g/mol): 219.24 MDL Number: MFCD00153767 InChI Key: ZXNRTKGTQJPIJK-UHFFFAOYSA-N Synonym: aniracetam,draganon,sarpul,1-4-methoxybenzoyl-2-pyrrolidinone,ampamet,1-4-methoxybenzoyl pyrrolidin-2-one,1-p-anisoyl-2-pyrrolidinone,memodrin,aniracetamun inn-latin,aniracetam usan:inn:jan PubChem CID: 2196 ChEBI: CHEBI:47943 IUPAC Name: 1-(4-methoxybenzoyl)pyrrolidin-2-one SMILES: COC1=CC=C(C=C1)C(=O)N2CCCC2=O
| PubChem CID | 2196 |
|---|---|
| CAS | 72432-10-1 |
| Molecular Weight (g/mol) | 219.24 |
| ChEBI | CHEBI:47943 |
| MDL Number | MFCD00153767 |
| SMILES | COC1=CC=C(C=C1)C(=O)N2CCCC2=O |
| Synonym | aniracetam,draganon,sarpul,1-4-methoxybenzoyl-2-pyrrolidinone,ampamet,1-4-methoxybenzoyl pyrrolidin-2-one,1-p-anisoyl-2-pyrrolidinone,memodrin,aniracetamun inn-latin,aniracetam usan:inn:jan |
| IUPAC Name | 1-(4-methoxybenzoyl)pyrrolidin-2-one |
| InChI Key | ZXNRTKGTQJPIJK-UHFFFAOYSA-N |
| Molecular Formula | C12H13NO3 |
1H-[1,2,4]Oxadiazolo[4,3-a]-quinoxalin-1-one, 98+%
CAS: 41443-28-1 Molecular Formula: C9H5N3O2 Molecular Weight (g/mol): 187.158 MDL Number: MFCD00792620 InChI Key: LZMHWZHOZLVYDL-UHFFFAOYSA-N Synonym: 1h-1,2,4 oxadiazolo 4,3-a quinoxalin-1-one,odq,1,2,4 oxadiazolo 4,3-a quinoxalin-1-one,unii-s57v2nmv38,1h-1,2,4 oxadiazolo 4,3-a-quinoxalin-1-one,1h-1,2,4 oxadiazolo-4,3,a quinoxalin-1-one,1-h-1,2,4 oxadiazolo-4,3,2 quinoxalin-1-ine,1h-odq PubChem CID: 1456 IUPAC Name: [1,2,4]oxadiazolo[4,3-a]quinoxalin-1-one SMILES: C1=CC=C2C(=C1)N=CC3=NOC(=O)N23
| PubChem CID | 1456 |
|---|---|
| CAS | 41443-28-1 |
| Molecular Weight (g/mol) | 187.158 |
| MDL Number | MFCD00792620 |
| SMILES | C1=CC=C2C(=C1)N=CC3=NOC(=O)N23 |
| Synonym | 1h-1,2,4 oxadiazolo 4,3-a quinoxalin-1-one,odq,1,2,4 oxadiazolo 4,3-a quinoxalin-1-one,unii-s57v2nmv38,1h-1,2,4 oxadiazolo 4,3-a-quinoxalin-1-one,1h-1,2,4 oxadiazolo-4,3,a quinoxalin-1-one,1-h-1,2,4 oxadiazolo-4,3,2 quinoxalin-1-ine,1h-odq |
| IUPAC Name | [1,2,4]oxadiazolo[4,3-a]quinoxalin-1-one |
| InChI Key | LZMHWZHOZLVYDL-UHFFFAOYSA-N |
| Molecular Formula | C9H5N3O2 |
Methyl nicotinate, 99%
CAS: 93-60-7 Molecular Formula: C7H7NO2 Molecular Weight (g/mol): 137.138 MDL Number: MFCD00006388 InChI Key: YNBADRVTZLEFNH-UHFFFAOYSA-N Synonym: methyl nicotinate,nikomet,methylnicotinate,nicotinic acid methyl ester,nicometh,methyl 3-pyridinecarboxylate,methyl-nicotinate,3-pyridinecarboxylic acid, methyl ester,heat spray,nicotinic acid, methyl ester PubChem CID: 7151 IUPAC Name: methyl pyridine-3-carboxylate SMILES: COC(=O)C1=CN=CC=C1
| PubChem CID | 7151 |
|---|---|
| CAS | 93-60-7 |
| Molecular Weight (g/mol) | 137.138 |
| MDL Number | MFCD00006388 |
| SMILES | COC(=O)C1=CN=CC=C1 |
| Synonym | methyl nicotinate,nikomet,methylnicotinate,nicotinic acid methyl ester,nicometh,methyl 3-pyridinecarboxylate,methyl-nicotinate,3-pyridinecarboxylic acid, methyl ester,heat spray,nicotinic acid, methyl ester |
| IUPAC Name | methyl pyridine-3-carboxylate |
| InChI Key | YNBADRVTZLEFNH-UHFFFAOYSA-N |
| Molecular Formula | C7H7NO2 |
N-Phenylmaleimide, 98+%
CAS: 941-69-5 Molecular Formula: C10H7NO2 Molecular Weight (g/mol): 173.171 MDL Number: MFCD00005502 InChI Key: HIDBROSJWZYGSZ-UHFFFAOYSA-N Synonym: n-phenylmaleimide,maleanil,maleinanil,maleimidobenzene,1h-pyrrole-2,5-dione, 1-phenyl,1-phenyl-1h-pyrrole-2,5-dione,maleimide, n-phenyl,1-phenyl-2,5-dihydro-1h-pyrrole-2,5-dione,unii-9u9kt462vw,n-fenylimid kyseliny maleinove PubChem CID: 13662 IUPAC Name: 1-phenylpyrrole-2,5-dione SMILES: C1=CC=C(C=C1)N2C(=O)C=CC2=O
| PubChem CID | 13662 |
|---|---|
| CAS | 941-69-5 |
| Molecular Weight (g/mol) | 173.171 |
| MDL Number | MFCD00005502 |
| SMILES | C1=CC=C(C=C1)N2C(=O)C=CC2=O |
| Synonym | n-phenylmaleimide,maleanil,maleinanil,maleimidobenzene,1h-pyrrole-2,5-dione, 1-phenyl,1-phenyl-1h-pyrrole-2,5-dione,maleimide, n-phenyl,1-phenyl-2,5-dihydro-1h-pyrrole-2,5-dione,unii-9u9kt462vw,n-fenylimid kyseliny maleinove |
| IUPAC Name | 1-phenylpyrrole-2,5-dione |
| InChI Key | HIDBROSJWZYGSZ-UHFFFAOYSA-N |
| Molecular Formula | C10H7NO2 |
Guanosine, 98%
CAS: 118-00-3 Molecular Formula: C10H13N5O5 Molecular Weight (g/mol): 283.24 MDL Number: MFCD00010182 InChI Key: NYHBQMYGNKIUIF-UUOKFMHZSA-N Synonym: guanosine,guanine riboside,vernine,guanozin,guanosin,inosine, 2-amino,usaf cb-11,vernine van,l-guanosine,9-beta-d-ribofuranosylguanine PubChem CID: 6802 ChEBI: CHEBI:16750 SMILES: NC1=NC2=C(N=CN2[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C(=O)N1
| PubChem CID | 6802 |
|---|---|
| CAS | 118-00-3 |
| Molecular Weight (g/mol) | 283.24 |
| ChEBI | CHEBI:16750 |
| MDL Number | MFCD00010182 |
| SMILES | NC1=NC2=C(N=CN2[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C(=O)N1 |
| Synonym | guanosine,guanine riboside,vernine,guanozin,guanosin,inosine, 2-amino,usaf cb-11,vernine van,l-guanosine,9-beta-d-ribofuranosylguanine |
| InChI Key | NYHBQMYGNKIUIF-UUOKFMHZSA-N |
| Molecular Formula | C10H13N5O5 |