Organoheterocyclic compounds
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3-Oxetanol, 95%
CAS: 7748-36-9 Molecular Formula: C3H6O2 Molecular Weight (g/mol): 74.08 MDL Number: MFCD09056790 InChI Key: QMLWSAXEQSBAAQ-UHFFFAOYSA-N Synonym: 3-hydroxyoxetane,3-oxetanol,1,3-epoxy-2-propanol,oxetane-3-ol,3-hydroxy-oxetane,3-hydroxy oxetane,pubchem17367,ksc380k3t,1,3-epoxypropan-2-ol PubChem CID: 9942117 IUPAC Name: oxetan-3-ol SMILES: OC1COC1
| PubChem CID | 9942117 |
|---|---|
| CAS | 7748-36-9 |
| Molecular Weight (g/mol) | 74.08 |
| MDL Number | MFCD09056790 |
| SMILES | OC1COC1 |
| Synonym | 3-hydroxyoxetane,3-oxetanol,1,3-epoxy-2-propanol,oxetane-3-ol,3-hydroxy-oxetane,3-hydroxy oxetane,pubchem17367,ksc380k3t,1,3-epoxypropan-2-ol |
| IUPAC Name | oxetan-3-ol |
| InChI Key | QMLWSAXEQSBAAQ-UHFFFAOYSA-N |
| Molecular Formula | C3H6O2 |
3-Oxetanyl p-toluenesulfonate, 96%, Thermo Scientific Chemicals
CAS: 26272-83-3 Molecular Formula: C10H12O4S Molecular Weight (g/mol): 228.262 MDL Number: MFCD08544401 InChI Key: UMFWNFVHKAJOSE-UHFFFAOYSA-N Synonym: 3-oxetanyl tosylate,toluene-4-sulfonic acid oxetan-3-yl ester,oxetan-3-yl 4-methylbenzene-1-sulfonate,3-tosyloxy oxetane,3-tosyloxyoxetane,3-oxetanyl p-toluenesulfonate,oxetan-3-yl-4-methylbenzenesulfonate,p-toluenesulfonic acid 3-oxetanyl ester,acmc-1cgaz,3-oxetanol, 3-4-methylbenzenesulfonate PubChem CID: 13153907 IUPAC Name: oxetan-3-yl 4-methylbenzenesulfonate SMILES: CC1=CC=C(C=C1)S(=O)(=O)OC2COC2
| PubChem CID | 13153907 |
|---|---|
| CAS | 26272-83-3 |
| Molecular Weight (g/mol) | 228.262 |
| MDL Number | MFCD08544401 |
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)OC2COC2 |
| Synonym | 3-oxetanyl tosylate,toluene-4-sulfonic acid oxetan-3-yl ester,oxetan-3-yl 4-methylbenzene-1-sulfonate,3-tosyloxy oxetane,3-tosyloxyoxetane,3-oxetanyl p-toluenesulfonate,oxetan-3-yl-4-methylbenzenesulfonate,p-toluenesulfonic acid 3-oxetanyl ester,acmc-1cgaz,3-oxetanol, 3-4-methylbenzenesulfonate |
| IUPAC Name | oxetan-3-yl 4-methylbenzenesulfonate |
| InChI Key | UMFWNFVHKAJOSE-UHFFFAOYSA-N |
| Molecular Formula | C10H12O4S |
1-Oxa-6-azaspiro[3.4]octane oxalate, 96%
CAS: 1408074-51-0 Molecular Formula: C8H13NO5 Molecular Weight (g/mol): 203.19 MDL Number: MFCD19982774 InChI Key: ZKTJFOHJBNDMDS-UHFFFAOYNA-N Synonym: 1-oxa-6-azaspiro 3.4 octane oxalate,1-oxa-6-azaspiro 3.4 octane; oxalic acid PubChem CID: 71432930 IUPAC Name: 1-oxa-7-azaspiro[3.4]octane;oxalic acid SMILES: OC(=O)C(O)=O.C1CC2(CCNC2)O1
| PubChem CID | 71432930 |
|---|---|
| CAS | 1408074-51-0 |
| Molecular Weight (g/mol) | 203.19 |
| MDL Number | MFCD19982774 |
| SMILES | OC(=O)C(O)=O.C1CC2(CCNC2)O1 |
| Synonym | 1-oxa-6-azaspiro 3.4 octane oxalate,1-oxa-6-azaspiro 3.4 octane; oxalic acid |
| IUPAC Name | 1-oxa-7-azaspiro[3.4]octane;oxalic acid |
| InChI Key | ZKTJFOHJBNDMDS-UHFFFAOYNA-N |
| Molecular Formula | C8H13NO5 |
2-(Bromomethyl)oxetane, 96%
CAS: 939759-23-6 Molecular Formula: C4H7BrO Molecular Weight (g/mol): 151.00 MDL Number: MFCD08544405 InChI Key: OMXAGUVERXNCSZ-UHFFFAOYNA-N Synonym: 2-bromomethyl oxetane,2-bromomethyl-oxetane,oxetane, 2-bromomethyl,cyclobutane, bromomethyl,2-bromomethyl oxetane oxetane, 2-bromomethyl PubChem CID: 16244494 IUPAC Name: 2-(bromomethyl)oxetane SMILES: BrCC1CCO1
| PubChem CID | 16244494 |
|---|---|
| CAS | 939759-23-6 |
| Molecular Weight (g/mol) | 151.00 |
| MDL Number | MFCD08544405 |
| SMILES | BrCC1CCO1 |
| Synonym | 2-bromomethyl oxetane,2-bromomethyl-oxetane,oxetane, 2-bromomethyl,cyclobutane, bromomethyl,2-bromomethyl oxetane oxetane, 2-bromomethyl |
| IUPAC Name | 2-(bromomethyl)oxetane |
| InChI Key | OMXAGUVERXNCSZ-UHFFFAOYNA-N |
| Molecular Formula | C4H7BrO |
3-Ethyl-3-oxetanemethanol, 97%
CAS: 3047-32-3 Molecular Formula: C6H12O2 Molecular Weight (g/mol): 116.16 MDL Number: MFCD00190143 InChI Key: UNMJLQGKEDTEKJ-UHFFFAOYSA-N Synonym: 3-ethyl-3-oxetanemethanol,3-ethyloxetan-3-yl methanol,3-oxetanemethanol, 3-ethyl,3-ethyloxetane-3-methanol,unii-622325vbyo,3-ethyl-3-hydroxymethyloxetane,3-hydroxymethyl-3-ethyloxetane,3-ethyl-3-hydroxymethyl oxetane,3-ethyl-oxetan-3-yl-methanol,2-hydroxymethyl-2-ethyl-1,3-epoxypropane PubChem CID: 76444 IUPAC Name: (3-ethyloxetan-3-yl)methanol SMILES: CCC1(COC1)CO
| PubChem CID | 76444 |
|---|---|
| CAS | 3047-32-3 |
| Molecular Weight (g/mol) | 116.16 |
| MDL Number | MFCD00190143 |
| SMILES | CCC1(COC1)CO |
| Synonym | 3-ethyl-3-oxetanemethanol,3-ethyloxetan-3-yl methanol,3-oxetanemethanol, 3-ethyl,3-ethyloxetane-3-methanol,unii-622325vbyo,3-ethyl-3-hydroxymethyloxetane,3-hydroxymethyl-3-ethyloxetane,3-ethyl-3-hydroxymethyl oxetane,3-ethyl-oxetan-3-yl-methanol,2-hydroxymethyl-2-ethyl-1,3-epoxypropane |
| IUPAC Name | (3-ethyloxetan-3-yl)methanol |
| InChI Key | UNMJLQGKEDTEKJ-UHFFFAOYSA-N |
| Molecular Formula | C6H12O2 |
2,3-Diamino-5-bromopyridine, 97%
CAS: 38875-53-5 Molecular Formula: C5H7BrN3 Molecular Weight (g/mol): 189.04 MDL Number: MFCD00460094 InChI Key: YRGMYJUKFJPNPD-UHFFFAOYSA-O Synonym: 2,3-diamino-5-bromopyridine,5-bromo-2,3-diaminopyridine,5-bromo-2,3-pyridinediamine,2,3-pyridinediamine, 5-bromo,3-amino-5-bromopyridin-2-yl amine,abbypharma ap-17-5972,5-brompyridin-2,3-diamin,pubchem5383,acmc-1adjl,5-brompyridin-2,3-diamine PubChem CID: 691156 IUPAC Name: 5-bromopyridine-2,3-diamine SMILES: NC1=CC(Br)=C[NH+]=C1N
| PubChem CID | 691156 |
|---|---|
| CAS | 38875-53-5 |
| Molecular Weight (g/mol) | 189.04 |
| MDL Number | MFCD00460094 |
| SMILES | NC1=CC(Br)=C[NH+]=C1N |
| Synonym | 2,3-diamino-5-bromopyridine,5-bromo-2,3-diaminopyridine,5-bromo-2,3-pyridinediamine,2,3-pyridinediamine, 5-bromo,3-amino-5-bromopyridin-2-yl amine,abbypharma ap-17-5972,5-brompyridin-2,3-diamin,pubchem5383,acmc-1adjl,5-brompyridin-2,3-diamine |
| IUPAC Name | 5-bromopyridine-2,3-diamine |
| InChI Key | YRGMYJUKFJPNPD-UHFFFAOYSA-O |
| Molecular Formula | C5H7BrN3 |
| CAS | 589-93-5 |
|---|
2-Cyano-4-methylpyridine, 98%
CAS: 1620-76-4 Molecular Formula: C7H6N2 Molecular Weight (g/mol): 118.139 MDL Number: MFCD00128868 InChI Key: LQAWSWUFSHYCHP-UHFFFAOYSA-N Synonym: 2-cyano-4-methylpyridine,4-methylpicolinonitrile,4-methyl-2-pyridinecarbonitrile,2-cyano-4-picoline,2-pyridinecarbonitrile, 4-methyl,pubchem21387,acmc-209dnq,2-cyano-4methylpyridine,2-cyano 4-methylpyridine,4-methyl-2-cyanopyridine PubChem CID: 88739 IUPAC Name: 4-methylpyridine-2-carbonitrile SMILES: CC1=CC(=NC=C1)C#N
| PubChem CID | 88739 |
|---|---|
| CAS | 1620-76-4 |
| Molecular Weight (g/mol) | 118.139 |
| MDL Number | MFCD00128868 |
| SMILES | CC1=CC(=NC=C1)C#N |
| Synonym | 2-cyano-4-methylpyridine,4-methylpicolinonitrile,4-methyl-2-pyridinecarbonitrile,2-cyano-4-picoline,2-pyridinecarbonitrile, 4-methyl,pubchem21387,acmc-209dnq,2-cyano-4methylpyridine,2-cyano 4-methylpyridine,4-methyl-2-cyanopyridine |
| IUPAC Name | 4-methylpyridine-2-carbonitrile |
| InChI Key | LQAWSWUFSHYCHP-UHFFFAOYSA-N |
| Molecular Formula | C7H6N2 |
Isonicotinic anhydride, 90%, remainder picolinic and nicotinic acid-anhydride
CAS: 7082-71-5 Molecular Formula: C12H8N2O3 Molecular Weight (g/mol): 228.2 MDL Number: MFCD00062784 InChI Key: ORBIGZZHMAJXAZ-UHFFFAOYSA-N Synonym: isonicotinic anhydride,isonictinic anhydride,acmc-1bcxw,isonicotinic acid anhydride,bis 4-pyridinecarboxylic anhydride,4-pyridinecarboxylicacid, anhydride with 4-pyridinecarboxylic acid,4-pyridinecarboxylic acid anhydride; pyridine-4-carboxylic acid anhydride PubChem CID: 81529 IUPAC Name: pyridine-4-carbonyl pyridine-4-carboxylate SMILES: C1=CN=CC=C1C(=O)OC(=O)C2=CC=NC=C2
| PubChem CID | 81529 |
|---|---|
| CAS | 7082-71-5 |
| Molecular Weight (g/mol) | 228.2 |
| MDL Number | MFCD00062784 |
| SMILES | C1=CN=CC=C1C(=O)OC(=O)C2=CC=NC=C2 |
| Synonym | isonicotinic anhydride,isonictinic anhydride,acmc-1bcxw,isonicotinic acid anhydride,bis 4-pyridinecarboxylic anhydride,4-pyridinecarboxylicacid, anhydride with 4-pyridinecarboxylic acid,4-pyridinecarboxylic acid anhydride; pyridine-4-carboxylic acid anhydride |
| IUPAC Name | pyridine-4-carbonyl pyridine-4-carboxylate |
| InChI Key | ORBIGZZHMAJXAZ-UHFFFAOYSA-N |
| Molecular Formula | C12H8N2O3 |
2-Methyl-6-(trifluoromethyl)nicotinic acid, Tech., Thermo Scientific™
CAS: 261635-93-2 Molecular Formula: C8H6F3NO2 Molecular Weight (g/mol): 205.14 MDL Number: MFCD01311990 InChI Key: ODWJFUQRQUCRJZ-UHFFFAOYSA-N Synonym: 2-methyl-6-trifluoromethyl nicotinic acid,2-methyl-6-trifluoromethyl pyridine-3-carboxylic acid,6-trifluoromethyl-2-methylpyridine-3-carboxylic acid,2-methyl-6-trifluoromethyl-nicotinic acid,maybridge4_000139,2-methyl-6-trifluoromethynicotinic acid,2-methyl-6-trifluoromethyinicotinic acid,2-methyl-6-trifluoromethylnicotinic acid,2-methyl-6-trifluoromethyl-3-pyridinecarboxylic acid PubChem CID: 2775683 IUPAC Name: 2-methyl-6-(trifluoromethyl)pyridine-3-carboxylic acid SMILES: CC1=C(C=CC(=N1)C(F)(F)F)C(O)=O
| PubChem CID | 2775683 |
|---|---|
| CAS | 261635-93-2 |
| Molecular Weight (g/mol) | 205.14 |
| MDL Number | MFCD01311990 |
| SMILES | CC1=C(C=CC(=N1)C(F)(F)F)C(O)=O |
| Synonym | 2-methyl-6-trifluoromethyl nicotinic acid,2-methyl-6-trifluoromethyl pyridine-3-carboxylic acid,6-trifluoromethyl-2-methylpyridine-3-carboxylic acid,2-methyl-6-trifluoromethyl-nicotinic acid,maybridge4_000139,2-methyl-6-trifluoromethynicotinic acid,2-methyl-6-trifluoromethyinicotinic acid,2-methyl-6-trifluoromethylnicotinic acid,2-methyl-6-trifluoromethyl-3-pyridinecarboxylic acid |
| IUPAC Name | 2-methyl-6-(trifluoromethyl)pyridine-3-carboxylic acid |
| InChI Key | ODWJFUQRQUCRJZ-UHFFFAOYSA-N |
| Molecular Formula | C8H6F3NO2 |
6-Bromo-7-azaindole, 96%
CAS: 143468-13-7 Molecular Formula: C7H5BrN2 Molecular Weight (g/mol): 197.035 MDL Number: MFCD06659667 InChI Key: LKXJGVGBEDEAAW-UHFFFAOYSA-N PubChem CID: 11159915 IUPAC Name: 6-bromo-1H-pyrrolo[2,3-b]pyridine SMILES: C1=CC(=NC2=C1C=CN2)Br
| PubChem CID | 11159915 |
|---|---|
| CAS | 143468-13-7 |
| Molecular Weight (g/mol) | 197.035 |
| MDL Number | MFCD06659667 |
| SMILES | C1=CC(=NC2=C1C=CN2)Br |
| IUPAC Name | 6-bromo-1H-pyrrolo[2,3-b]pyridine |
| InChI Key | LKXJGVGBEDEAAW-UHFFFAOYSA-N |
| Molecular Formula | C7H5BrN2 |
6-Phenylnicotinaldehyde, 97%, Thermo Scientific™
CAS: 63056-20-2 Molecular Formula: C12H9NO Molecular Weight (g/mol): 183.21 MDL Number: MFCD03086130 InChI Key: HWDMDOSKSDLXEH-UHFFFAOYSA-N Synonym: 6-phenylnicotinaldehyde,6-phenylpyridine-3-carboxaldehyde,2-phenyl-5-pyridinecarboxaldehyde,6-phenyl-3-pyridinecarboxaldehyde,3-pyridinecarboxaldehyde, 6-phenyl,2-phenylpyridine-5-carbaldehyde,6-phenyl-pyridine-3-carbaldehyde PubChem CID: 2764562 IUPAC Name: 6-phenylpyridine-3-carbaldehyde SMILES: C1=CC=C(C=C1)C2=NC=C(C=C2)C=O
| PubChem CID | 2764562 |
|---|---|
| CAS | 63056-20-2 |
| Molecular Weight (g/mol) | 183.21 |
| MDL Number | MFCD03086130 |
| SMILES | C1=CC=C(C=C1)C2=NC=C(C=C2)C=O |
| Synonym | 6-phenylnicotinaldehyde,6-phenylpyridine-3-carboxaldehyde,2-phenyl-5-pyridinecarboxaldehyde,6-phenyl-3-pyridinecarboxaldehyde,3-pyridinecarboxaldehyde, 6-phenyl,2-phenylpyridine-5-carbaldehyde,6-phenyl-pyridine-3-carbaldehyde |
| IUPAC Name | 6-phenylpyridine-3-carbaldehyde |
| InChI Key | HWDMDOSKSDLXEH-UHFFFAOYSA-N |
| Molecular Formula | C12H9NO |
2-Amino-6-chloropyridine, 98%
CAS: 45644-21-1 Molecular Formula: C5H5ClN2 Molecular Weight (g/mol): 128.559 MDL Number: MFCD00234068 InChI Key: OBYJTLDIQBWBHM-UHFFFAOYSA-N Synonym: 2-amino-6-chloropyridine,2-chloro-6-aminopyridine,2-pyridinamine, 6-chloro,6-chloro-2-pyridinamine,6-chloro-pyridin-2-ylamine,pyridine, 2-amino-6-chloro,6-chloropyridin-2-ylamine,6-chloro-2-pyridylamine,6-amino-2-chloropyridine,2-amino-6-chloropyridine 6-chloropyridin-2-ylamine PubChem CID: 206246 IUPAC Name: 6-chloropyridin-2-amine SMILES: C1=CC(=NC(=C1)Cl)N
| PubChem CID | 206246 |
|---|---|
| CAS | 45644-21-1 |
| Molecular Weight (g/mol) | 128.559 |
| MDL Number | MFCD00234068 |
| SMILES | C1=CC(=NC(=C1)Cl)N |
| Synonym | 2-amino-6-chloropyridine,2-chloro-6-aminopyridine,2-pyridinamine, 6-chloro,6-chloro-2-pyridinamine,6-chloro-pyridin-2-ylamine,pyridine, 2-amino-6-chloro,6-chloropyridin-2-ylamine,6-chloro-2-pyridylamine,6-amino-2-chloropyridine,2-amino-6-chloropyridine 6-chloropyridin-2-ylamine |
| IUPAC Name | 6-chloropyridin-2-amine |
| InChI Key | OBYJTLDIQBWBHM-UHFFFAOYSA-N |
| Molecular Formula | C5H5ClN2 |
Picolinamide, 98%
CAS: 1452-77-3 Molecular Formula: C6H6N2O Molecular Weight (g/mol): 122.13 MDL Number: MFCD00023483 InChI Key: IBBMAWULFFBRKK-UHFFFAOYSA-N Synonym: picolinamide,2-pyridinecarboxamide,picolinoylamide,2-carbamoylpyridine,picolinic acid amide,2-picolinamide,2-aminocarbonyl-pyridine,alpha-picolinamide,pyridinecarboxamide,unii-i3550ccl59 PubChem CID: 15070 ChEBI: CHEBI:8200 IUPAC Name: pyridine-2-carboxamide SMILES: NC(=O)C1=CC=CC=N1
| PubChem CID | 15070 |
|---|---|
| CAS | 1452-77-3 |
| Molecular Weight (g/mol) | 122.13 |
| ChEBI | CHEBI:8200 |
| MDL Number | MFCD00023483 |
| SMILES | NC(=O)C1=CC=CC=N1 |
| Synonym | picolinamide,2-pyridinecarboxamide,picolinoylamide,2-carbamoylpyridine,picolinic acid amide,2-picolinamide,2-aminocarbonyl-pyridine,alpha-picolinamide,pyridinecarboxamide,unii-i3550ccl59 |
| IUPAC Name | pyridine-2-carboxamide |
| InChI Key | IBBMAWULFFBRKK-UHFFFAOYSA-N |
| Molecular Formula | C6H6N2O |
2-Chloro-5-fluoropyridine, 95%
CAS: 31301-51-6 Molecular Formula: C5H3ClFN Molecular Weight (g/mol): 131.53 MDL Number: MFCD03095332 InChI Key: QOGXQLSFJCIDNY-UHFFFAOYSA-N Synonym: 2-chloro-5-fluoro-pyridine,2-chloro-5-fluoro pyridine,pyridine, 2-chloro-5-fluoro,zlchem 338,pubchem1097,2-chlor-5-fluorpyridin,acmc-1aevz,2-chloro-5-fluropyridine,ksc223e3t,tpc-py082 PubChem CID: 2782801 IUPAC Name: 2-chloro-5-fluoropyridine SMILES: FC1=CN=C(Cl)C=C1
| PubChem CID | 2782801 |
|---|---|
| CAS | 31301-51-6 |
| Molecular Weight (g/mol) | 131.53 |
| MDL Number | MFCD03095332 |
| SMILES | FC1=CN=C(Cl)C=C1 |
| Synonym | 2-chloro-5-fluoro-pyridine,2-chloro-5-fluoro pyridine,pyridine, 2-chloro-5-fluoro,zlchem 338,pubchem1097,2-chlor-5-fluorpyridin,acmc-1aevz,2-chloro-5-fluropyridine,ksc223e3t,tpc-py082 |
| IUPAC Name | 2-chloro-5-fluoropyridine |
| InChI Key | QOGXQLSFJCIDNY-UHFFFAOYSA-N |
| Molecular Formula | C5H3ClFN |