Organoheterocyclic compounds
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5-Methylisophthalic acid, 98%
CAS: 499-49-0 Molecular Formula: C9H8O4 Molecular Weight (g/mol): 180.159 MDL Number: MFCD00013986 InChI Key: PMZBHPUNQNKBOA-UHFFFAOYSA-N Synonym: 5-methylisophthalic acid,uvitic acid,5-methyl-1,3-benzenedicarboxylic acid,isophthalic acid, 5-methyl,1,3-benzenedicarboxylic acid, 5-methyl,uvitinsaure,3,5-dicarboxytoluene,5-methylisophthalicacid,acmc-209kj2,ksc237e4t PubChem CID: 68137 IUPAC Name: 5-methylbenzene-1,3-dicarboxylic acid SMILES: CC1=CC(=CC(=C1)C(=O)O)C(=O)O
| PubChem CID | 68137 |
|---|---|
| CAS | 499-49-0 |
| Molecular Weight (g/mol) | 180.159 |
| MDL Number | MFCD00013986 |
| SMILES | CC1=CC(=CC(=C1)C(=O)O)C(=O)O |
| Synonym | 5-methylisophthalic acid,uvitic acid,5-methyl-1,3-benzenedicarboxylic acid,isophthalic acid, 5-methyl,1,3-benzenedicarboxylic acid, 5-methyl,uvitinsaure,3,5-dicarboxytoluene,5-methylisophthalicacid,acmc-209kj2,ksc237e4t |
| IUPAC Name | 5-methylbenzene-1,3-dicarboxylic acid |
| InChI Key | PMZBHPUNQNKBOA-UHFFFAOYSA-N |
| Molecular Formula | C9H8O4 |
6-Amino-3-chloro-1H-indazole, 97%
CAS: 21413-23-0 Molecular Formula: C7H6ClN3 Molecular Weight (g/mol): 167.60 MDL Number: MFCD07781648 InChI Key: DRRARKIFTNKQDW-UHFFFAOYSA-N Synonym: 3-chloro-1h-indazol-6-amine,6-amino-3-chloro-1h-indazole,1h-indazol-6-amine,3-chloro,6-amino-3-chloroindazole,3-chloro-1h-indazole-6-ylamine,3-chloro-1h-indazol-6-ylamine,6-amino-3-chloro 1h indazole,pubchem23042,3-chloro-indazol-6-amine PubChem CID: 14790453 IUPAC Name: 3-chloro-2H-indazol-6-amine SMILES: NC1=CC2=NNC(Cl)=C2C=C1
| PubChem CID | 14790453 |
|---|---|
| CAS | 21413-23-0 |
| Molecular Weight (g/mol) | 167.60 |
| MDL Number | MFCD07781648 |
| SMILES | NC1=CC2=NNC(Cl)=C2C=C1 |
| Synonym | 3-chloro-1h-indazol-6-amine,6-amino-3-chloro-1h-indazole,1h-indazol-6-amine,3-chloro,6-amino-3-chloroindazole,3-chloro-1h-indazole-6-ylamine,3-chloro-1h-indazol-6-ylamine,6-amino-3-chloro 1h indazole,pubchem23042,3-chloro-indazol-6-amine |
| IUPAC Name | 3-chloro-2H-indazol-6-amine |
| InChI Key | DRRARKIFTNKQDW-UHFFFAOYSA-N |
| Molecular Formula | C7H6ClN3 |
N-Hydroxysuccinimide, Spectrum™ Chemical
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CAS: 6066-82-6
| CAS | 6066-82-6 |
|---|
1-Ethylpyridinium bromide, 99%
CAS: 1906-79-2 Molecular Formula: C7H10BrN Molecular Weight (g/mol): 188.068 MDL Number: MFCD00041999 InChI Key: ABFDKXBSQCTIKH-UHFFFAOYSA-M Synonym: 1-ethylpyridinium bromide,1-ethylpyridin-1-ium bromide,ethylpyridinium bromide,pyridinium, 1-ethyl-, bromide,n-ethylpyridinium bromide,pyridinium, 1-ethyl-, bromide 1:1,pyridineethobromide,ethylpyridiniumbromide,1-ethyl-pyridiniubromide,n-ethyl pyridinium bromide PubChem CID: 15927 IUPAC Name: 1-ethylpyridin-1-ium;bromide SMILES: CC[N+]1=CC=CC=C1.[Br-]
| PubChem CID | 15927 |
|---|---|
| CAS | 1906-79-2 |
| Molecular Weight (g/mol) | 188.068 |
| MDL Number | MFCD00041999 |
| SMILES | CC[N+]1=CC=CC=C1.[Br-] |
| Synonym | 1-ethylpyridinium bromide,1-ethylpyridin-1-ium bromide,ethylpyridinium bromide,pyridinium, 1-ethyl-, bromide,n-ethylpyridinium bromide,pyridinium, 1-ethyl-, bromide 1:1,pyridineethobromide,ethylpyridiniumbromide,1-ethyl-pyridiniubromide,n-ethyl pyridinium bromide |
| IUPAC Name | 1-ethylpyridin-1-ium;bromide |
| InChI Key | ABFDKXBSQCTIKH-UHFFFAOYSA-M |
| Molecular Formula | C7H10BrN |
Ethyl 2-chlorooxazole-4-carboxylate, 95%, Thermo Scientific Chemicals
CAS: 460081-18-9 Molecular Formula: C6H6ClNO3 Molecular Weight (g/mol): 175.568 MDL Number: MFCD06660120 InChI Key: SYWQOPRAPDMWMC-UHFFFAOYSA-N PubChem CID: 2763184 IUPAC Name: ethyl 2-chloro-1,3-oxazole-4-carboxylate SMILES: CCOC(=O)C1=COC(=N1)Cl
| PubChem CID | 2763184 |
|---|---|
| CAS | 460081-18-9 |
| Molecular Weight (g/mol) | 175.568 |
| MDL Number | MFCD06660120 |
| SMILES | CCOC(=O)C1=COC(=N1)Cl |
| IUPAC Name | ethyl 2-chloro-1,3-oxazole-4-carboxylate |
| InChI Key | SYWQOPRAPDMWMC-UHFFFAOYSA-N |
| Molecular Formula | C6H6ClNO3 |
3-Amino-6-chloropyridazine, 98%
CAS: 5469-69-2 Molecular Formula: C4H4ClN3 Molecular Weight (g/mol): 129.55 MDL Number: MFCD00051506 InChI Key: DTXVKPOKPFWSFF-UHFFFAOYSA-N Synonym: 3-amino-6-chloropyridazine,3-pyridazinamine, 6-chloro,6-chloro-3-pyridazinamine,6-amino-3-chloropyridazine,6-chloro-3-aminopyridazine,6-chloropyridazin-3-ylamine,6-chloro-pyridazin-3-ylamine,unii-ijs443slzg,3-chloro-6-pyridazinamine,6-chloro-3-pyridazinylamine PubChem CID: 21643 IUPAC Name: 6-chloropyridazin-3-amine SMILES: NC1=CC=C(Cl)N=N1
| PubChem CID | 21643 |
|---|---|
| CAS | 5469-69-2 |
| Molecular Weight (g/mol) | 129.55 |
| MDL Number | MFCD00051506 |
| SMILES | NC1=CC=C(Cl)N=N1 |
| Synonym | 3-amino-6-chloropyridazine,3-pyridazinamine, 6-chloro,6-chloro-3-pyridazinamine,6-amino-3-chloropyridazine,6-chloro-3-aminopyridazine,6-chloropyridazin-3-ylamine,6-chloro-pyridazin-3-ylamine,unii-ijs443slzg,3-chloro-6-pyridazinamine,6-chloro-3-pyridazinylamine |
| IUPAC Name | 6-chloropyridazin-3-amine |
| InChI Key | DTXVKPOKPFWSFF-UHFFFAOYSA-N |
| Molecular Formula | C4H4ClN3 |
2,3-Dimethylquinoxaline, 97%
CAS: 2379-55-7 Molecular Formula: C10H10N2 Molecular Weight (g/mol): 158.204 MDL Number: MFCD00006728 InChI Key: FKHNZQFCDGOQGV-UHFFFAOYSA-N PubChem CID: 16925 IUPAC Name: 2,3-dimethylquinoxaline SMILES: CC1=NC2=CC=CC=C2N=C1C
| PubChem CID | 16925 |
|---|---|
| CAS | 2379-55-7 |
| Molecular Weight (g/mol) | 158.204 |
| MDL Number | MFCD00006728 |
| SMILES | CC1=NC2=CC=CC=C2N=C1C |
| IUPAC Name | 2,3-dimethylquinoxaline |
| InChI Key | FKHNZQFCDGOQGV-UHFFFAOYSA-N |
| Molecular Formula | C10H10N2 |
1-Boc-3-(methylamino)piperidine, 97%
CAS: 392331-89-4 Molecular Formula: C11H22N2O2 Molecular Weight (g/mol): 214.31 MDL Number: MFCD04114980,MFCD09752963 InChI Key: XRRRUOWSHGFPTI-UHFFFAOYNA-N Synonym: 1-boc-3-methylaminopiperidine,tert-butyl 3-methylamino piperidine-1-carboxylate,1-boc-3-methylaminopieridine,n-boc-3-methylamino piperidine,1-n-boc-3-methylaminopiperidine,1-boc-3-methykaminopiperidine,n-boc-3-methylaminopiperidine,3-methylamino-piperidine-1-carboxylic acid tert-butyl ester,1-boc-3-methylamino piperidine,3-methylamino piperidine-1-carboxylic acid tert-butyl ester PubChem CID: 17750458 IUPAC Name: tert-butyl 3-(methylamino)piperidine-1-carboxylate SMILES: CNC1CCCN(C1)C(=O)OC(C)(C)C
| PubChem CID | 17750458 |
|---|---|
| CAS | 392331-89-4 |
| Molecular Weight (g/mol) | 214.31 |
| MDL Number | MFCD04114980,MFCD09752963 |
| SMILES | CNC1CCCN(C1)C(=O)OC(C)(C)C |
| Synonym | 1-boc-3-methylaminopiperidine,tert-butyl 3-methylamino piperidine-1-carboxylate,1-boc-3-methylaminopieridine,n-boc-3-methylamino piperidine,1-n-boc-3-methylaminopiperidine,1-boc-3-methykaminopiperidine,n-boc-3-methylaminopiperidine,3-methylamino-piperidine-1-carboxylic acid tert-butyl ester,1-boc-3-methylamino piperidine,3-methylamino piperidine-1-carboxylic acid tert-butyl ester |
| IUPAC Name | tert-butyl 3-(methylamino)piperidine-1-carboxylate |
| InChI Key | XRRRUOWSHGFPTI-UHFFFAOYNA-N |
| Molecular Formula | C11H22N2O2 |
3-Amino-1H-pyrazole-4-carbonitrile, 98%
CAS: 16617-46-2 Molecular Formula: C4H4N4 Molecular Weight (g/mol): 108.104 MDL Number: MFCD00005237 InChI Key: FFNKBQRKZRMYCL-UHFFFAOYSA-N Synonym: 3-amino-4-pyrazolecarbonitrile,3-amino-1h-pyrazole-4-carbonitrile,3-amino-4-cyanopyrazole,3-aminopyrazole-4-carbonitrile,5-amino-4-cyanopyrazole,1h-pyrazole-4-carbonitrile, 3-amino,5-aminopyrazole-4-carbonitrile,3-amino-4-cyano-1h-pyrazole,4-cyano-5-aminopyrazole,3-amino-4-cyano pyrazole PubChem CID: 85515 IUPAC Name: 5-amino-1H-pyrazole-4-carbonitrile SMILES: C1=NNC(=C1C#N)N
| PubChem CID | 85515 |
|---|---|
| CAS | 16617-46-2 |
| Molecular Weight (g/mol) | 108.104 |
| MDL Number | MFCD00005237 |
| SMILES | C1=NNC(=C1C#N)N |
| Synonym | 3-amino-4-pyrazolecarbonitrile,3-amino-1h-pyrazole-4-carbonitrile,3-amino-4-cyanopyrazole,3-aminopyrazole-4-carbonitrile,5-amino-4-cyanopyrazole,1h-pyrazole-4-carbonitrile, 3-amino,5-aminopyrazole-4-carbonitrile,3-amino-4-cyano-1h-pyrazole,4-cyano-5-aminopyrazole,3-amino-4-cyano pyrazole |
| IUPAC Name | 5-amino-1H-pyrazole-4-carbonitrile |
| InChI Key | FFNKBQRKZRMYCL-UHFFFAOYSA-N |
| Molecular Formula | C4H4N4 |
Xanthane Hydride, Spectrum™ Chemical
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CAS: 6846-35-1
| CAS | 6846-35-1 |
|---|
3,5-Dimethyl-1H-pyrazole-4-sulfonyl chloride, 97%
CAS: 80466-78-0 Molecular Formula: C5H7ClN2O2S Molecular Weight (g/mol): 194.63 MDL Number: MFCD04969910 InChI Key: NBGSZCQLPLYKJH-UHFFFAOYSA-N Synonym: 1h-pyrazole-4-sulfonylchloride, 3,5-dimethyl,3,5-dimethylpyrazol-4-yl chlorosulfone,1h-pyrazole-4-sulfonyl chloride, 3,5-dimethyl,pyrazole, 4-chlorosulfonyl-3,5-dimethyl,3,5-dimethyl-1h-pyrazole-4-sulfonylchloride,# PubChem CID: 594587 IUPAC Name: 3,5-dimethyl-1H-pyrazole-4-sulfonyl chloride SMILES: CC1=C(C(C)=NN1)S(Cl)(=O)=O
| PubChem CID | 594587 |
|---|---|
| CAS | 80466-78-0 |
| Molecular Weight (g/mol) | 194.63 |
| MDL Number | MFCD04969910 |
| SMILES | CC1=C(C(C)=NN1)S(Cl)(=O)=O |
| Synonym | 1h-pyrazole-4-sulfonylchloride, 3,5-dimethyl,3,5-dimethylpyrazol-4-yl chlorosulfone,1h-pyrazole-4-sulfonyl chloride, 3,5-dimethyl,pyrazole, 4-chlorosulfonyl-3,5-dimethyl,3,5-dimethyl-1h-pyrazole-4-sulfonylchloride,# |
| IUPAC Name | 3,5-dimethyl-1H-pyrazole-4-sulfonyl chloride |
| InChI Key | NBGSZCQLPLYKJH-UHFFFAOYSA-N |
| Molecular Formula | C5H7ClN2O2S |
1-Boc-pyrrole-2-boronic acid pinacol ester, 97%
CAS: 1072944-98-9 Molecular Formula: C15H24BNO4 Molecular Weight (g/mol): 293.17 MDL Number: MFCD11504960 InChI Key: DZQURIUJAGTAFW-UHFFFAOYSA-N Synonym: tert-butyl 2-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl-1h-pyrrole-1-carboxylate,1-boc-pyrrole-2-boronic acid, pinacol ester,1-boc-pyrrole-2-boronic acid pinacol ester,t-butyl 2-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl-1h-pyrrole-1-carboxylate,tert-butyl 2-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl pyrrole-1-carboxylate,pubchem23523,1-boc-pyrrole-2-boronic acid,pinacol ester,1-tert-butoxycarbonyl-1h-pyrrol-2-yl boronic acid pinacol ester,1-boc-2-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl-1h-pyrrole,tert-butyl 2-tetramethyl-1,3,2-dioxaborolan-2-yl-1h-pyrrole-1-carboxylate PubChem CID: 46739108 IUPAC Name: tert-butyl 2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrrole-1-carboxylate SMILES: B1(OC(C(O1)(C)C)(C)C)C2=CC=CN2C(=O)OC(C)(C)C
| PubChem CID | 46739108 |
|---|---|
| CAS | 1072944-98-9 |
| Molecular Weight (g/mol) | 293.17 |
| MDL Number | MFCD11504960 |
| SMILES | B1(OC(C(O1)(C)C)(C)C)C2=CC=CN2C(=O)OC(C)(C)C |
| Synonym | tert-butyl 2-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl-1h-pyrrole-1-carboxylate,1-boc-pyrrole-2-boronic acid, pinacol ester,1-boc-pyrrole-2-boronic acid pinacol ester,t-butyl 2-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl-1h-pyrrole-1-carboxylate,tert-butyl 2-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl pyrrole-1-carboxylate,pubchem23523,1-boc-pyrrole-2-boronic acid,pinacol ester,1-tert-butoxycarbonyl-1h-pyrrol-2-yl boronic acid pinacol ester,1-boc-2-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl-1h-pyrrole,tert-butyl 2-tetramethyl-1,3,2-dioxaborolan-2-yl-1h-pyrrole-1-carboxylate |
| IUPAC Name | tert-butyl 2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrrole-1-carboxylate |
| InChI Key | DZQURIUJAGTAFW-UHFFFAOYSA-N |
| Molecular Formula | C15H24BNO4 |
2-Methyl-2-oxazoline, 99%
CAS: 1120-64-5 Molecular Formula: C4H7NO Molecular Weight (g/mol): 85.11 MDL Number: MFCD00005298 InChI Key: GUXJXWKCUUWCLX-UHFFFAOYSA-N Synonym: 2-methyl-2-oxazoline,2-methyloxazoline,2-methyl-4,5-dihydrooxazole,oxazole, 4,5-dihydro-2-methyl,2-methyl-2-oxazolin,2-methyl-1,3-oxazoline,2-oxazoline, 2-methyl,4,5-dihydro-2-methyl-1,3-oxazole,poly 2-methyl-2-oxazoline,methyl oxazoline PubChem CID: 70713 ChEBI: CHEBI:53614 IUPAC Name: 2-methyl-4,5-dihydro-1,3-oxazole SMILES: CC1=NCCO1
| PubChem CID | 70713 |
|---|---|
| CAS | 1120-64-5 |
| Molecular Weight (g/mol) | 85.11 |
| ChEBI | CHEBI:53614 |
| MDL Number | MFCD00005298 |
| SMILES | CC1=NCCO1 |
| Synonym | 2-methyl-2-oxazoline,2-methyloxazoline,2-methyl-4,5-dihydrooxazole,oxazole, 4,5-dihydro-2-methyl,2-methyl-2-oxazolin,2-methyl-1,3-oxazoline,2-oxazoline, 2-methyl,4,5-dihydro-2-methyl-1,3-oxazole,poly 2-methyl-2-oxazoline,methyl oxazoline |
| IUPAC Name | 2-methyl-4,5-dihydro-1,3-oxazole |
| InChI Key | GUXJXWKCUUWCLX-UHFFFAOYSA-N |
| Molecular Formula | C4H7NO |
1-Boc-2-phenylpiperazine, 97%
CAS: 886766-60-5 Molecular Formula: C15H22N2O2 Molecular Weight (g/mol): 262.353 MDL Number: MFCD07367734 InChI Key: DVOURBIBCQYVCC-UHFFFAOYSA-N Synonym: 1-boc-2-phenylpiperazine,n-1-boc-2-phenyl piperizine,n-1-boc-2-phenylpiperazine,1-n-boc-2-phenylpiperazine,n-boc-2-bhenyl piperazine,2-phenylpiperazine, n1-boc protected,2-phenyl-piperazine-1-carboxylic acid tert-butyl ester,n1-boc-2-phenylpiperazine,n-1-boc-2-phenyl-piperazine,tert-butyl 2-phenylpiperazinecarboxylate PubChem CID: 16740572 IUPAC Name: tert-butyl 2-phenylpiperazine-1-carboxylate SMILES: CC(C)(C)OC(=O)N1CCNCC1C2=CC=CC=C2
| PubChem CID | 16740572 |
|---|---|
| CAS | 886766-60-5 |
| Molecular Weight (g/mol) | 262.353 |
| MDL Number | MFCD07367734 |
| SMILES | CC(C)(C)OC(=O)N1CCNCC1C2=CC=CC=C2 |
| Synonym | 1-boc-2-phenylpiperazine,n-1-boc-2-phenyl piperizine,n-1-boc-2-phenylpiperazine,1-n-boc-2-phenylpiperazine,n-boc-2-bhenyl piperazine,2-phenylpiperazine, n1-boc protected,2-phenyl-piperazine-1-carboxylic acid tert-butyl ester,n1-boc-2-phenylpiperazine,n-1-boc-2-phenyl-piperazine,tert-butyl 2-phenylpiperazinecarboxylate |
| IUPAC Name | tert-butyl 2-phenylpiperazine-1-carboxylate |
| InChI Key | DVOURBIBCQYVCC-UHFFFAOYSA-N |
| Molecular Formula | C15H22N2O2 |
2,2':6',2″-Terpyridine, 96%
CAS: 1148-79-4 Molecular Formula: C15H11N3 Molecular Weight (g/mol): 233.27 MDL Number: MFCD00006213 InChI Key: DRGAZIDRYFYHIJ-UHFFFAOYSA-N Synonym: 2,2':6',2-terpyridine,tripyridyl,tripyridine,2,6-bis 2-pyridyl pyridine,terpy,terpyridine,2,2',2-terpyridine,2,2',2-terpyridyl,2,2',2-tripyridyl,2,2',2-tripyridine PubChem CID: 70848 ChEBI: CHEBI:245199 IUPAC Name: 2,6-dipyridin-2-ylpyridine SMILES: C1=CC=C(N=C1)C1=CC=CC(=N1)C1=CC=CC=N1
| PubChem CID | 70848 |
|---|---|
| CAS | 1148-79-4 |
| Molecular Weight (g/mol) | 233.27 |
| ChEBI | CHEBI:245199 |
| MDL Number | MFCD00006213 |
| SMILES | C1=CC=C(N=C1)C1=CC=CC(=N1)C1=CC=CC=N1 |
| Synonym | 2,2':6',2-terpyridine,tripyridyl,tripyridine,2,6-bis 2-pyridyl pyridine,terpy,terpyridine,2,2',2-terpyridine,2,2',2-terpyridyl,2,2',2-tripyridyl,2,2',2-tripyridine |
| IUPAC Name | 2,6-dipyridin-2-ylpyridine |
| InChI Key | DRGAZIDRYFYHIJ-UHFFFAOYSA-N |
| Molecular Formula | C15H11N3 |