Organoheterocyclic compounds
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1-Methyl-1H-pyrazole-3-sulfonyl chloride, 97%, Thermo Scientific™
CAS: 89501-90-6 Molecular Formula: C4H5ClN2O2S Molecular Weight (g/mol): 180.606 MDL Number: MFCD08690273 InChI Key: TWLAHGNFQBQYEL-UHFFFAOYSA-N Synonym: 1-methyl-1h-pyrazole-3-sulfonyl chloride,1-methyl-1h-pyrazole-3-sulfonylchloride,1h-pyrazole-3-sulfonyl chloride, 1-methyl,1h-pyrazole-3-sulfonylchloride, 1-methyl,pubchem14132,acmc-209zg6,n-methylpyrazole sulfonyl chloride,chloro 1-methylpyrazol-3-yl sulfone,1-methyl-3-pyrazolesulfonyl chloride,methyl-1-h-pyrazole-3-sulfonyl chloride PubChem CID: 13474466 IUPAC Name: 1-methylpyrazole-3-sulfonyl chloride SMILES: CN1C=CC(=N1)S(=O)(=O)Cl
| PubChem CID | 13474466 |
|---|---|
| CAS | 89501-90-6 |
| Molecular Weight (g/mol) | 180.606 |
| MDL Number | MFCD08690273 |
| SMILES | CN1C=CC(=N1)S(=O)(=O)Cl |
| Synonym | 1-methyl-1h-pyrazole-3-sulfonyl chloride,1-methyl-1h-pyrazole-3-sulfonylchloride,1h-pyrazole-3-sulfonyl chloride, 1-methyl,1h-pyrazole-3-sulfonylchloride, 1-methyl,pubchem14132,acmc-209zg6,n-methylpyrazole sulfonyl chloride,chloro 1-methylpyrazol-3-yl sulfone,1-methyl-3-pyrazolesulfonyl chloride,methyl-1-h-pyrazole-3-sulfonyl chloride |
| IUPAC Name | 1-methylpyrazole-3-sulfonyl chloride |
| InChI Key | TWLAHGNFQBQYEL-UHFFFAOYSA-N |
| Molecular Formula | C4H5ClN2O2S |
4-(1H-Pyrazol-1-ylmethyl)aniline, 95%, Thermo Scientific™
CAS: 142335-61-3 Molecular Formula: C10H11N3 Molecular Weight (g/mol): 173.22 MDL Number: MFCD03422514 InChI Key: ISRYTHBRUSOVAB-UHFFFAOYSA-N Synonym: 4-1h-pyrazol-1-ylmethyl aniline,4-1h-pyrazol-1-yl methyl aniline,4-pyrazol-1-ylmethyl aniline,4-1-pyrazolyl methyl aniline,4-pyrazol-1-ylmethyl-phenylamine,4-pyrazol-1-ylmethylphenylamine,benzenamine,4-1h-pyrazol-1-ylmethyl,4-pyrazolylmethyl phenylamine,pyrazolylmethylaniline PubChem CID: 2764412 IUPAC Name: 4-(pyrazol-1-ylmethyl)aniline SMILES: NC1=CC=C(CN2C=CC=N2)C=C1
| PubChem CID | 2764412 |
|---|---|
| CAS | 142335-61-3 |
| Molecular Weight (g/mol) | 173.22 |
| MDL Number | MFCD03422514 |
| SMILES | NC1=CC=C(CN2C=CC=N2)C=C1 |
| Synonym | 4-1h-pyrazol-1-ylmethyl aniline,4-1h-pyrazol-1-yl methyl aniline,4-pyrazol-1-ylmethyl aniline,4-1-pyrazolyl methyl aniline,4-pyrazol-1-ylmethyl-phenylamine,4-pyrazol-1-ylmethylphenylamine,benzenamine,4-1h-pyrazol-1-ylmethyl,4-pyrazolylmethyl phenylamine,pyrazolylmethylaniline |
| IUPAC Name | 4-(pyrazol-1-ylmethyl)aniline |
| InChI Key | ISRYTHBRUSOVAB-UHFFFAOYSA-N |
| Molecular Formula | C10H11N3 |
1-Methylpyrazole, 98%
CAS: 930-36-9 Molecular Formula: C4H6N2 Molecular Weight (g/mol): 82.1 MDL Number: MFCD00144943 InChI Key: UQFQONCQIQEYPJ-UHFFFAOYSA-N Synonym: 1-methyl-1h-pyrazole,n-methylpyrazole,1h-pyrazole, 1-methyl,pyrazole, 1-methyl,methylpyrazole,1-methyl pyrazole,1-methypyrazole,n-methyl pyrazole,1-methyl-pyrazole,zlchem 255 PubChem CID: 70255 ChEBI: CHEBI:59025 IUPAC Name: 1-methylpyrazole SMILES: CN1C=CC=N1
| PubChem CID | 70255 |
|---|---|
| CAS | 930-36-9 |
| Molecular Weight (g/mol) | 82.1 |
| ChEBI | CHEBI:59025 |
| MDL Number | MFCD00144943 |
| SMILES | CN1C=CC=N1 |
| Synonym | 1-methyl-1h-pyrazole,n-methylpyrazole,1h-pyrazole, 1-methyl,pyrazole, 1-methyl,methylpyrazole,1-methyl pyrazole,1-methypyrazole,n-methyl pyrazole,1-methyl-pyrazole,zlchem 255 |
| IUPAC Name | 1-methylpyrazole |
| InChI Key | UQFQONCQIQEYPJ-UHFFFAOYSA-N |
| Molecular Formula | C4H6N2 |
1-Methyl-1H-indazole-3-carbaldehyde, 97%, Thermo Scientific™
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CAS: 4002-83-9 Molecular Formula: C9H8N2O Molecular Weight (g/mol): 160.18 MDL Number: MFCD08060478 InChI Key: KYDLGYCLCFKUHY-UHFFFAOYSA-N Synonym: 1-methyl-1h-indazole-3-carbaldehyde,1-methyl-1h-indazole-3-carboxaldehyde,3-formyl-1-methyl-1h-indazole,1-methyl-3-formylindazole,1h-indazole-3-carboxaldehyde,1-methyl PubChem CID: 7164545 IUPAC Name: 1-methylindazole-3-carbaldehyde SMILES: CN1N=C(C=O)C2=CC=CC=C12
| PubChem CID | 7164545 |
|---|---|
| CAS | 4002-83-9 |
| Molecular Weight (g/mol) | 160.18 |
| MDL Number | MFCD08060478 |
| SMILES | CN1N=C(C=O)C2=CC=CC=C12 |
| Synonym | 1-methyl-1h-indazole-3-carbaldehyde,1-methyl-1h-indazole-3-carboxaldehyde,3-formyl-1-methyl-1h-indazole,1-methyl-3-formylindazole,1h-indazole-3-carboxaldehyde,1-methyl |
| IUPAC Name | 1-methylindazole-3-carbaldehyde |
| InChI Key | KYDLGYCLCFKUHY-UHFFFAOYSA-N |
| Molecular Formula | C9H8N2O |
3-(Chloromethyl)-5-(2-furyl)-1-methyl-1H-pyrazole, 95%, Thermo Scientific™
CAS: 876316-48-2 Molecular Formula: C9H9ClN2O Molecular Weight (g/mol): 196.63 MDL Number: MFCD08690269 InChI Key: DZUIHVJDKDNADW-UHFFFAOYSA-N Synonym: 3-chloromethyl-5-2-furyl-1-methyl-1h-pyrazole,3-chloromethyl-5-furan-2-yl-1-methylpyrazole,1h-pyrazole,3-chloromethyl-5-2-furanyl-1-methyl,3-chloromethyl-5-furan-2-yl-1-methyl-1h-pyrazole,2-3-chloromethyl-1-methylpyrazol-5-yl furan PubChem CID: 18525803 IUPAC Name: 3-(chloromethyl)-5-(furan-2-yl)-1-methylpyrazole SMILES: CN1N=C(CCl)C=C1C1=CC=CO1
| PubChem CID | 18525803 |
|---|---|
| CAS | 876316-48-2 |
| Molecular Weight (g/mol) | 196.63 |
| MDL Number | MFCD08690269 |
| SMILES | CN1N=C(CCl)C=C1C1=CC=CO1 |
| Synonym | 3-chloromethyl-5-2-furyl-1-methyl-1h-pyrazole,3-chloromethyl-5-furan-2-yl-1-methylpyrazole,1h-pyrazole,3-chloromethyl-5-2-furanyl-1-methyl,3-chloromethyl-5-furan-2-yl-1-methyl-1h-pyrazole,2-3-chloromethyl-1-methylpyrazol-5-yl furan |
| IUPAC Name | 3-(chloromethyl)-5-(furan-2-yl)-1-methylpyrazole |
| InChI Key | DZUIHVJDKDNADW-UHFFFAOYSA-N |
| Molecular Formula | C9H9ClN2O |
1-Methyl-1H-pyrazole, 97+%
CAS: 930-36-9 Molecular Formula: C4H6N2 Molecular Weight (g/mol): 82.106 MDL Number: MFCD00144943 InChI Key: UQFQONCQIQEYPJ-UHFFFAOYSA-N Synonym: 1-methyl-1h-pyrazole,n-methylpyrazole,1h-pyrazole, 1-methyl,pyrazole, 1-methyl,methylpyrazole,1-methyl pyrazole,1-methypyrazole,n-methyl pyrazole,1-methyl-pyrazole,zlchem 255 PubChem CID: 70255 ChEBI: CHEBI:59025 IUPAC Name: 1-methylpyrazole SMILES: CN1C=CC=N1
| PubChem CID | 70255 |
|---|---|
| CAS | 930-36-9 |
| Molecular Weight (g/mol) | 82.106 |
| ChEBI | CHEBI:59025 |
| MDL Number | MFCD00144943 |
| SMILES | CN1C=CC=N1 |
| Synonym | 1-methyl-1h-pyrazole,n-methylpyrazole,1h-pyrazole, 1-methyl,pyrazole, 1-methyl,methylpyrazole,1-methyl pyrazole,1-methypyrazole,n-methyl pyrazole,1-methyl-pyrazole,zlchem 255 |
| IUPAC Name | 1-methylpyrazole |
| InChI Key | UQFQONCQIQEYPJ-UHFFFAOYSA-N |
| Molecular Formula | C4H6N2 |
1H-Indazole-6-carboxaldehyde, 97%
CAS: 669050-69-5 Molecular Formula: C8H6N2O Molecular Weight (g/mol): 146.15 InChI Key: JTWYTTXTJFDYAG-UHFFFAOYSA-N Synonym: 1h-indazole-6-carboxaldehyde,6-formylindazole,6-formyl-1h-indazole,2h-indazole-6-carbaldehyde,indazole-6-carboxaldehyde,1h-indazole-6-cabaldehyde,pubchem23878,acmc-1bc45,2h-indazole-6-carboxaldehyde,1-h-indazole-6-carboxaldehyde PubChem CID: 18538368 IUPAC Name: 1H-indazole-6-carbaldehyde SMILES: C1=CC2=C(C=C1C=O)NN=C2
| PubChem CID | 18538368 |
|---|---|
| CAS | 669050-69-5 |
| Molecular Weight (g/mol) | 146.15 |
| SMILES | C1=CC2=C(C=C1C=O)NN=C2 |
| Synonym | 1h-indazole-6-carboxaldehyde,6-formylindazole,6-formyl-1h-indazole,2h-indazole-6-carbaldehyde,indazole-6-carboxaldehyde,1h-indazole-6-cabaldehyde,pubchem23878,acmc-1bc45,2h-indazole-6-carboxaldehyde,1-h-indazole-6-carboxaldehyde |
| IUPAC Name | 1H-indazole-6-carbaldehyde |
| InChI Key | JTWYTTXTJFDYAG-UHFFFAOYSA-N |
| Molecular Formula | C8H6N2O |
[3-(2-Furyl)-1-methyl-1H-pyrazol-5-yl]methanol 97+%, Thermo Scientific™
CAS: 886851-33-8 Molecular Formula: C9H10N2O2 Molecular Weight (g/mol): 178.191 InChI Key: BYXYWFXMSJTOKB-UHFFFAOYSA-N Synonym: 3-2-furyl-1-methyl-1h-pyrazol-5-yl methanol,5-furan-2-yl-2-methylpyrazol-3-yl methanol,3-2-furyl-1-methylpyrazol-5-yl methan-1-ol,3-furan-2-yl-1-methyl-1h-pyrazol-5-yl methanol PubChem CID: 18525804 IUPAC Name: [5-(furan-2-yl)-2-methylpyrazol-3-yl]methanol SMILES: CN1C(=CC(=N1)C2=CC=CO2)CO
| PubChem CID | 18525804 |
|---|---|
| CAS | 886851-33-8 |
| Molecular Weight (g/mol) | 178.191 |
| SMILES | CN1C(=CC(=N1)C2=CC=CO2)CO |
| Synonym | 3-2-furyl-1-methyl-1h-pyrazol-5-yl methanol,5-furan-2-yl-2-methylpyrazol-3-yl methanol,3-2-furyl-1-methylpyrazol-5-yl methan-1-ol,3-furan-2-yl-1-methyl-1h-pyrazol-5-yl methanol |
| IUPAC Name | [5-(furan-2-yl)-2-methylpyrazol-3-yl]methanol |
| InChI Key | BYXYWFXMSJTOKB-UHFFFAOYSA-N |
| Molecular Formula | C9H10N2O2 |
5-Amino-1-methyl-1H-pyrazole, 97%
CAS: 1192-21-8 Molecular Formula: C4H7N3 Molecular Weight (g/mol): 97.12 InChI Key: JESRNIJXVIFVOV-UHFFFAOYSA-N Synonym: 1-methyl-1h-pyrazol-5-amine,1-methyl-1h-pyrazol-5-ylamine,1-methyl-5-aminopyrazole,5-amino-1-methylpyrazole,5-amino-1-methyl-1h-pyrazole,1h-pyrazol-5-amine, 1-methyl,2-methyl-2h-pyrazol-3-ylamine,5-amino-1-methyl-pyrazole,2-methyl-2h-pyrazol-3-amine,1-methylpyrazole-5-ylamine PubChem CID: 136927 IUPAC Name: 2-methylpyrazol-3-amine SMILES: CN1C(=CC=N1)N
| PubChem CID | 136927 |
|---|---|
| CAS | 1192-21-8 |
| Molecular Weight (g/mol) | 97.12 |
| SMILES | CN1C(=CC=N1)N |
| Synonym | 1-methyl-1h-pyrazol-5-amine,1-methyl-1h-pyrazol-5-ylamine,1-methyl-5-aminopyrazole,5-amino-1-methylpyrazole,5-amino-1-methyl-1h-pyrazole,1h-pyrazol-5-amine, 1-methyl,2-methyl-2h-pyrazol-3-ylamine,5-amino-1-methyl-pyrazole,2-methyl-2h-pyrazol-3-amine,1-methylpyrazole-5-ylamine |
| IUPAC Name | 2-methylpyrazol-3-amine |
| InChI Key | JESRNIJXVIFVOV-UHFFFAOYSA-N |
| Molecular Formula | C4H7N3 |
5-Fluoro-1H-indazole, 98%
CAS: 348-26-5 Molecular Formula: C7H5FN2 Molecular Weight (g/mol): 136.129 MDL Number: MFCD04972877 InChI Key: LIWIWTHSKJBYDW-UHFFFAOYSA-N Synonym: 5-fluoroindazole,5-fluoro-2h-indazole,1h-indazole, 5-fluoro,chembl16076,5-fluoranyl-1h-indazole,2h-indazole, 5-fluoro,acmc-209zy1,indazole, 5-fluoro,5-fluoro-1h-indazole PubChem CID: 17842486 IUPAC Name: 5-fluoro-1H-indazole SMILES: C1=CC2=C(C=C1F)C=NN2
| PubChem CID | 17842486 |
|---|---|
| CAS | 348-26-5 |
| Molecular Weight (g/mol) | 136.129 |
| MDL Number | MFCD04972877 |
| SMILES | C1=CC2=C(C=C1F)C=NN2 |
| Synonym | 5-fluoroindazole,5-fluoro-2h-indazole,1h-indazole, 5-fluoro,chembl16076,5-fluoranyl-1h-indazole,2h-indazole, 5-fluoro,acmc-209zy1,indazole, 5-fluoro,5-fluoro-1h-indazole |
| IUPAC Name | 5-fluoro-1H-indazole |
| InChI Key | LIWIWTHSKJBYDW-UHFFFAOYSA-N |
| Molecular Formula | C7H5FN2 |
3-Phthalimidopropionic acid, 98%
CAS: 3339-73-9 Molecular Formula: C11H9NO4 Molecular Weight (g/mol): 219.196 MDL Number: MFCD00023096 InChI Key: DXXHRZUOTPMGEH-UHFFFAOYSA-N Synonym: 3-phthalimidopropionic acid,3-1,3-dioxoisoindolin-2-yl propanoic acid,2h-isoindole-2-propanoic acid, 1,3-dihydro-1,3-dioxo,3-1,3-dioxo-1,3-dihydro-2h-isoindol-2-yl propanoic acid,3-1,3-dioxo-2,3-dihydro-1h-isoindol-2-yl propanoic acid,pht-beta-ala-oh,b-phthalimidopropionic acid,3-phthalimidopropanoic acid,n-phthaloyl-beta-alanine,phthalyl-.beta.-alanine PubChem CID: 76859 IUPAC Name: 3-(1,3-dioxoisoindol-2-yl)propanoic acid SMILES: C1=CC=C2C(=C1)C(=O)N(C2=O)CCC(=O)O
| PubChem CID | 76859 |
|---|---|
| CAS | 3339-73-9 |
| Molecular Weight (g/mol) | 219.196 |
| MDL Number | MFCD00023096 |
| SMILES | C1=CC=C2C(=C1)C(=O)N(C2=O)CCC(=O)O |
| Synonym | 3-phthalimidopropionic acid,3-1,3-dioxoisoindolin-2-yl propanoic acid,2h-isoindole-2-propanoic acid, 1,3-dihydro-1,3-dioxo,3-1,3-dioxo-1,3-dihydro-2h-isoindol-2-yl propanoic acid,3-1,3-dioxo-2,3-dihydro-1h-isoindol-2-yl propanoic acid,pht-beta-ala-oh,b-phthalimidopropionic acid,3-phthalimidopropanoic acid,n-phthaloyl-beta-alanine,phthalyl-.beta.-alanine |
| IUPAC Name | 3-(1,3-dioxoisoindol-2-yl)propanoic acid |
| InChI Key | DXXHRZUOTPMGEH-UHFFFAOYSA-N |
| Molecular Formula | C11H9NO4 |
Methyl indole-5-carboxylate, 97%
CAS: 1011-65-0 Molecular Formula: C10H9NO2 Molecular Weight (g/mol): 175.187 MDL Number: MFCD00153023 InChI Key: DRYBMFJLYYEOBZ-UHFFFAOYSA-N Synonym: methyl indole-5-carboxylate,indole-5-carboxylic acid methyl ester,1h-indole-5-carboxylic acid, methyl ester,methylindole-5-carboxylate,1h-indole-5-carboxylic acid methyl ester,indole5carboxylicacidmethylester,indole-5-carboxylicacidmethylester,indole-5-carboxylate,pubchem7248,5-methoxycarbonylindole PubChem CID: 2737635 IUPAC Name: methyl 1H-indole-5-carboxylate SMILES: COC(=O)C1=CC2=C(C=C1)NC=C2
| PubChem CID | 2737635 |
|---|---|
| CAS | 1011-65-0 |
| Molecular Weight (g/mol) | 175.187 |
| MDL Number | MFCD00153023 |
| SMILES | COC(=O)C1=CC2=C(C=C1)NC=C2 |
| Synonym | methyl indole-5-carboxylate,indole-5-carboxylic acid methyl ester,1h-indole-5-carboxylic acid, methyl ester,methylindole-5-carboxylate,1h-indole-5-carboxylic acid methyl ester,indole5carboxylicacidmethylester,indole-5-carboxylicacidmethylester,indole-5-carboxylate,pubchem7248,5-methoxycarbonylindole |
| IUPAC Name | methyl 1H-indole-5-carboxylate |
| InChI Key | DRYBMFJLYYEOBZ-UHFFFAOYSA-N |
| Molecular Formula | C10H9NO2 |
2-(3-Chloro-4-fluorophenyl)indole, 98%
CAS: 1868-88-8 Molecular Formula: C14H9ClFN Molecular Weight (g/mol): 245.681 MDL Number: MFCD00068179 InChI Key: QNYJRNHACDLRSI-UHFFFAOYSA-N PubChem CID: 2736577 IUPAC Name: 2-(3-chloro-4-fluorophenyl)-1H-indole SMILES: C1=CC=C2C(=C1)C=C(N2)C3=CC(=C(C=C3)F)Cl
| PubChem CID | 2736577 |
|---|---|
| CAS | 1868-88-8 |
| Molecular Weight (g/mol) | 245.681 |
| MDL Number | MFCD00068179 |
| SMILES | C1=CC=C2C(=C1)C=C(N2)C3=CC(=C(C=C3)F)Cl |
| IUPAC Name | 2-(3-chloro-4-fluorophenyl)-1H-indole |
| InChI Key | QNYJRNHACDLRSI-UHFFFAOYSA-N |
| Molecular Formula | C14H9ClFN |
Indole-3-propionic acid, ∽99%, MP Biomedicals™
CAS: 830-96-6 Molecular Formula: C11H11NO2 Molecular Weight (g/mol): 189.21 MDL Number: MFCD00005660 InChI Key: GOLXRNDWAUTYKT-UHFFFAOYSA-N Synonym: 3-indolepropionic acid,indole-3-propionic acid,3-1h-indol-3-yl propanoic acid,1h-indole-3-propanoic acid,indolepropionic acid,indolylpropionic acid,3-3-indolyl propionic acid,3-3-indolyl propanoic acid,ipa auxin,1h-indole-3-propionic acid PubChem CID: 3744 ChEBI: CHEBI:43580 IUPAC Name: 3-(1H-indol-3-yl)propanoic acid SMILES: OC(=O)CCC1=CNC2=CC=CC=C12
| PubChem CID | 3744 |
|---|---|
| CAS | 830-96-6 |
| Molecular Weight (g/mol) | 189.21 |
| ChEBI | CHEBI:43580 |
| MDL Number | MFCD00005660 |
| SMILES | OC(=O)CCC1=CNC2=CC=CC=C12 |
| Synonym | 3-indolepropionic acid,indole-3-propionic acid,3-1h-indol-3-yl propanoic acid,1h-indole-3-propanoic acid,indolepropionic acid,indolylpropionic acid,3-3-indolyl propionic acid,3-3-indolyl propanoic acid,ipa auxin,1h-indole-3-propionic acid |
| IUPAC Name | 3-(1H-indol-3-yl)propanoic acid |
| InChI Key | GOLXRNDWAUTYKT-UHFFFAOYSA-N |
| Molecular Formula | C11H11NO2 |
6-Bromo-1-methyl-1H-indole, ≥97%, Thermo Scientific™
CAS: 125872-95-9 Molecular Formula: C9H8BrN Molecular Weight (g/mol): 210.07 MDL Number: MFCD08543444 InChI Key: PXHJDPPKNUGKPM-UHFFFAOYSA-N Synonym: 6-bromo-1-methyl-1h-indole,1h-indole,6-bromo-1-methyl,acmc-20eb8h,6-bromo-1-methyl indole,1-methyl-6-bromo-1h-indole,1h-indole, 6-bromo-1-methyl PubChem CID: 15546854 SMILES: CN1C=CC2=CC=C(Br)C=C12
| PubChem CID | 15546854 |
|---|---|
| CAS | 125872-95-9 |
| Molecular Weight (g/mol) | 210.07 |
| MDL Number | MFCD08543444 |
| SMILES | CN1C=CC2=CC=C(Br)C=C12 |
| Synonym | 6-bromo-1-methyl-1h-indole,1h-indole,6-bromo-1-methyl,acmc-20eb8h,6-bromo-1-methyl indole,1-methyl-6-bromo-1h-indole,1h-indole, 6-bromo-1-methyl |
| InChI Key | PXHJDPPKNUGKPM-UHFFFAOYSA-N |
| Molecular Formula | C9H8BrN |