Organoheterocyclic compounds
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Ethyl 2-methylpyridine-4-carboxylate hydrochloride, 95%
CAS: 65550-32-5 Molecular Formula: C9H12ClNO2 Molecular Weight (g/mol): 201.65 MDL Number: MFCD09991690 InChI Key: DPRMHHCAVHGENN-UHFFFAOYSA-N Synonym: ethyl 2-methylisonicotinate hydrochloride,ethyl 2-methylpyridine-4-carboxylate hydrochloride,ethyl 2-methylisonicotinate hcl,2-methylisonicotinic acid ethyl ester hydrochloride,acmc-20al0t,2-methyl-isonicotinic acid ethyl ester hydrochloride,2-methyl-4-pyridinecarboxylic acid ethyl ester hydrochloride,ethyl 2-methylpyridine-4-carboxylate-hydrogen chloride 1/1,4-pyridinecarboxylic acid, 2-methyl-, ethyl ester, hydrochloride PubChem CID: 53229930 SMILES: Cl.CCOC(=O)C1=CC(C)=NC=C1
| PubChem CID | 53229930 |
|---|---|
| CAS | 65550-32-5 |
| Molecular Weight (g/mol) | 201.65 |
| MDL Number | MFCD09991690 |
| SMILES | Cl.CCOC(=O)C1=CC(C)=NC=C1 |
| Synonym | ethyl 2-methylisonicotinate hydrochloride,ethyl 2-methylpyridine-4-carboxylate hydrochloride,ethyl 2-methylisonicotinate hcl,2-methylisonicotinic acid ethyl ester hydrochloride,acmc-20al0t,2-methyl-isonicotinic acid ethyl ester hydrochloride,2-methyl-4-pyridinecarboxylic acid ethyl ester hydrochloride,ethyl 2-methylpyridine-4-carboxylate-hydrogen chloride 1/1,4-pyridinecarboxylic acid, 2-methyl-, ethyl ester, hydrochloride |
| InChI Key | DPRMHHCAVHGENN-UHFFFAOYSA-N |
| Molecular Formula | C9H12ClNO2 |
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 |
4,7-Dibromo-2,1,3-benzothiadiazole, 97%
CAS: 15155-41-6 Molecular Formula: C6H2Br2N2S Molecular Weight (g/mol): 293.96 MDL Number: MFCD00658844 InChI Key: FEOWHLLJXAECMU-UHFFFAOYSA-N Synonym: 4,7-dibromobenzo c 1,2,5 thiadiazole,4,7-dibromo-2,1,3-benzothidiazole,4,7-dibromobenzo c-1,2,5-thiadiazole,2,1,3-benzothiadiazole, 4,7-dibromo,acmc-1bu18,ksc490o9b,4,7-dibromobenzo 1,2,5 thiadiazole,4,7-dibromobenzo 2,1,3 thiadiazole,4,7-dibromo-2,1,3-benzothiadiazole,4,7-dibromo-benzo 1,2,5 thiadiazole PubChem CID: 626361 IUPAC Name: 4,7-dibromo-2,1,3-benzothiadiazole SMILES: BrC1=CC=C(Br)C2=NSN=C12
| PubChem CID | 626361 |
|---|---|
| CAS | 15155-41-6 |
| Molecular Weight (g/mol) | 293.96 |
| MDL Number | MFCD00658844 |
| SMILES | BrC1=CC=C(Br)C2=NSN=C12 |
| Synonym | 4,7-dibromobenzo c 1,2,5 thiadiazole,4,7-dibromo-2,1,3-benzothidiazole,4,7-dibromobenzo c-1,2,5-thiadiazole,2,1,3-benzothiadiazole, 4,7-dibromo,acmc-1bu18,ksc490o9b,4,7-dibromobenzo 1,2,5 thiadiazole,4,7-dibromobenzo 2,1,3 thiadiazole,4,7-dibromo-2,1,3-benzothiadiazole,4,7-dibromo-benzo 1,2,5 thiadiazole |
| IUPAC Name | 4,7-dibromo-2,1,3-benzothiadiazole |
| InChI Key | FEOWHLLJXAECMU-UHFFFAOYSA-N |
| Molecular Formula | C6H2Br2N2S |
3-Amino-3-methyloxetane, 95%
CAS: 874473-14-0 Molecular Formula: C4H9NO Molecular Weight (g/mol): 87.122 MDL Number: MFCD11111713 InChI Key: NQVWMPOQWBDSAI-UHFFFAOYSA-N Synonym: 3-methyl-3-oxetanamine,3-amino-3-methyloxetane,3-oxetanamine,3-methyl,3-oxetanamine, 3-methyl,pubchem14416,pubchem23160,acmc-209qnl,3-methyl 3-oxetanamine,3-methyl-3-oxetaneamine,3-amino-3-methyl-oxetane PubChem CID: 46835725 IUPAC Name: 3-methyloxetan-3-amine SMILES: CC1(COC1)N
| PubChem CID | 46835725 |
|---|---|
| CAS | 874473-14-0 |
| Molecular Weight (g/mol) | 87.122 |
| MDL Number | MFCD11111713 |
| SMILES | CC1(COC1)N |
| Synonym | 3-methyl-3-oxetanamine,3-amino-3-methyloxetane,3-oxetanamine,3-methyl,3-oxetanamine, 3-methyl,pubchem14416,pubchem23160,acmc-209qnl,3-methyl 3-oxetanamine,3-methyl-3-oxetaneamine,3-amino-3-methyl-oxetane |
| IUPAC Name | 3-methyloxetan-3-amine |
| InChI Key | NQVWMPOQWBDSAI-UHFFFAOYSA-N |
| Molecular Formula | C4H9NO |
5-Chlorothiophene-2-carbonyl chloride, 98%
CAS: 42518-98-9 Molecular Formula: C5H2Cl2OS Molecular Weight (g/mol): 181.03 MDL Number: MFCD00043886 InChI Key: BMPDCQVRKDNUAP-UHFFFAOYSA-N Synonym: 5-chlorothiophene-2-carbonylchloride,5-chorothiophene-2-carbonyl chloride,5-chloro-2-thiophenecarbonyl chloride,5-chloro-thiophene-2-carbonyl chloride,5-chloro-2-thenoyl chloride,2-thiophenecarbonyl chloride, 5-chloro,pubchem16132,ksc235i7t,5-chlorothiophenecarbonyl chloride,5-chloro-2-thenoylchloride PubChem CID: 589223 IUPAC Name: 5-chlorothiophene-2-carbonyl chloride SMILES: ClC(=O)C1=CC=C(Cl)S1
| PubChem CID | 589223 |
|---|---|
| CAS | 42518-98-9 |
| Molecular Weight (g/mol) | 181.03 |
| MDL Number | MFCD00043886 |
| SMILES | ClC(=O)C1=CC=C(Cl)S1 |
| Synonym | 5-chlorothiophene-2-carbonylchloride,5-chorothiophene-2-carbonyl chloride,5-chloro-2-thiophenecarbonyl chloride,5-chloro-thiophene-2-carbonyl chloride,5-chloro-2-thenoyl chloride,2-thiophenecarbonyl chloride, 5-chloro,pubchem16132,ksc235i7t,5-chlorothiophenecarbonyl chloride,5-chloro-2-thenoylchloride |
| IUPAC Name | 5-chlorothiophene-2-carbonyl chloride |
| InChI Key | BMPDCQVRKDNUAP-UHFFFAOYSA-N |
| Molecular Formula | C5H2Cl2OS |
(S)-(+)-Epichlorohydrin, 98+%
CAS: 67843-74-7 Molecular Formula: C3H5ClO Molecular Weight (g/mol): 92.52 MDL Number: MFCD00077760 InChI Key: BRLQWZUYTZBJKN-GSVOUGTGSA-N Synonym: s-+-epichlorohydrin,s-epichlorohydrin,2s-2-chloromethyl oxirane,s-chloromethyl oxirane,s-3-chloropropylene oxide,s-2-chloromethyl oxirane,epichlorohydrin, +,unii-scr89b4r6o,ccris 6388 PubChem CID: 149428 ChEBI: CHEBI:37145 IUPAC Name: (2S)-2-(chloromethyl)oxirane SMILES: ClC[C@@H]1CO1
| PubChem CID | 149428 |
|---|---|
| CAS | 67843-74-7 |
| Molecular Weight (g/mol) | 92.52 |
| ChEBI | CHEBI:37145 |
| MDL Number | MFCD00077760 |
| SMILES | ClC[C@@H]1CO1 |
| Synonym | s-+-epichlorohydrin,s-epichlorohydrin,2s-2-chloromethyl oxirane,s-chloromethyl oxirane,s-3-chloropropylene oxide,s-2-chloromethyl oxirane,epichlorohydrin, +,unii-scr89b4r6o,ccris 6388 |
| IUPAC Name | (2S)-2-(chloromethyl)oxirane |
| InChI Key | BRLQWZUYTZBJKN-GSVOUGTGSA-N |
| Molecular Formula | C3H5ClO |
delta-Octanolactone, 97%
CAS: 698-76-0 Molecular Formula: C8H14O2 Molecular Weight (g/mol): 142.198 MDL Number: MFCD00144051 InChI Key: FYTRVXSHONWYNE-UHFFFAOYSA-N Synonym: delta-octanolactone,delta-octalactone,5-octanolide,5-hydroxyoctanoic acid lactone,2h-pyran-2-one, tetrahydro-6-propyl,5-octalactone,.delta.-octalactone,tetrahydro-6-propyl-2h-pyran-2-one,delta-octanolide,fema no. 3214 PubChem CID: 12777 IUPAC Name: 6-propyloxan-2-one SMILES: CCCC1CCCC(=O)O1
| PubChem CID | 12777 |
|---|---|
| CAS | 698-76-0 |
| Molecular Weight (g/mol) | 142.198 |
| MDL Number | MFCD00144051 |
| SMILES | CCCC1CCCC(=O)O1 |
| Synonym | delta-octanolactone,delta-octalactone,5-octanolide,5-hydroxyoctanoic acid lactone,2h-pyran-2-one, tetrahydro-6-propyl,5-octalactone,.delta.-octalactone,tetrahydro-6-propyl-2h-pyran-2-one,delta-octanolide,fema no. 3214 |
| IUPAC Name | 6-propyloxan-2-one |
| InChI Key | FYTRVXSHONWYNE-UHFFFAOYSA-N |
| Molecular Formula | C8H14O2 |
3-Amino-2-bromopyridine, 97%
CAS: 39856-58-1 Molecular Formula: C5H5BrN2 Molecular Weight (g/mol): 173.013 MDL Number: MFCD00234064 InChI Key: HKDVVTLISGIPFE-UHFFFAOYSA-N Synonym: 3-amino-2-bromopyridine,2-bromo-3-aminopyridine,2-bromo-pyridineamine,3-pyridinamine, 2-bromo,2-bromo-3-pyridinamine,2-bromo-3-pyridylamine,2-bromopyridine-3-amine,3-amino-2-bromo-pyridine,2-bromo-3-pyridineamine,2-bromo-pyridin-3-ylamine PubChem CID: 642816 IUPAC Name: 2-bromopyridin-3-amine SMILES: C1=CC(=C(N=C1)Br)N
| PubChem CID | 642816 |
|---|---|
| CAS | 39856-58-1 |
| Molecular Weight (g/mol) | 173.013 |
| MDL Number | MFCD00234064 |
| SMILES | C1=CC(=C(N=C1)Br)N |
| Synonym | 3-amino-2-bromopyridine,2-bromo-3-aminopyridine,2-bromo-pyridineamine,3-pyridinamine, 2-bromo,2-bromo-3-pyridinamine,2-bromo-3-pyridylamine,2-bromopyridine-3-amine,3-amino-2-bromo-pyridine,2-bromo-3-pyridineamine,2-bromo-pyridin-3-ylamine |
| IUPAC Name | 2-bromopyridin-3-amine |
| InChI Key | HKDVVTLISGIPFE-UHFFFAOYSA-N |
| Molecular Formula | C5H5BrN2 |
5-Bromo-2-thiophenemethanol, 95%
CAS: 79387-71-6 Molecular Formula: C5H5BrOS Molecular Weight (g/mol): 193.06 MDL Number: MFCD06202626 InChI Key: DBRSLMCLMMFHEF-UHFFFAOYSA-N PubChem CID: 11435467 IUPAC Name: (5-bromothiophen-2-yl)methanol SMILES: OCC1=CC=C(Br)S1
| PubChem CID | 11435467 |
|---|---|
| CAS | 79387-71-6 |
| Molecular Weight (g/mol) | 193.06 |
| MDL Number | MFCD06202626 |
| SMILES | OCC1=CC=C(Br)S1 |
| IUPAC Name | (5-bromothiophen-2-yl)methanol |
| InChI Key | DBRSLMCLMMFHEF-UHFFFAOYSA-N |
| Molecular Formula | C5H5BrOS |
2-Aminopyridine-4-carboxamide, 95%
CAS: 13538-42-6 Molecular Formula: C6H7N3O Molecular Weight (g/mol): 137.14 MDL Number: MFCD03791262 InChI Key: AGSDASDGMNDAIE-UHFFFAOYSA-N PubChem CID: 351653 IUPAC Name: 2-aminopyridine-4-carboxamide SMILES: NC(=O)C1=CC=NC(N)=C1
| PubChem CID | 351653 |
|---|---|
| CAS | 13538-42-6 |
| Molecular Weight (g/mol) | 137.14 |
| MDL Number | MFCD03791262 |
| SMILES | NC(=O)C1=CC=NC(N)=C1 |
| IUPAC Name | 2-aminopyridine-4-carboxamide |
| InChI Key | AGSDASDGMNDAIE-UHFFFAOYSA-N |
| Molecular Formula | C6H7N3O |
3-Amino-4-methylpyridine, 98%
CAS: 3430-27-1 Molecular Formula: C6H8N2 Molecular Weight (g/mol): 108.144 MDL Number: MFCD00128871 InChI Key: IBKMZYWDWWIWEL-UHFFFAOYSA-N Synonym: 3-amino-4-methylpyridine,3-amino-4-picoline,3-pyridinamine, 4-methyl,4-methyl-3-pyridinamine,4-methyl-pyridin-3-ylamine,unii-9hn55rq07b,4-methyl-3-pyridylamine,4-methylpyridine-3-amine,3-amino-4-methyl pyridine,3-amino-4-methylpyridine 3-amino-4-picoline PubChem CID: 137935 IUPAC Name: 4-methylpyridin-3-amine SMILES: CC1=C(C=NC=C1)N
| PubChem CID | 137935 |
|---|---|
| CAS | 3430-27-1 |
| Molecular Weight (g/mol) | 108.144 |
| MDL Number | MFCD00128871 |
| SMILES | CC1=C(C=NC=C1)N |
| Synonym | 3-amino-4-methylpyridine,3-amino-4-picoline,3-pyridinamine, 4-methyl,4-methyl-3-pyridinamine,4-methyl-pyridin-3-ylamine,unii-9hn55rq07b,4-methyl-3-pyridylamine,4-methylpyridine-3-amine,3-amino-4-methyl pyridine,3-amino-4-methylpyridine 3-amino-4-picoline |
| IUPAC Name | 4-methylpyridin-3-amine |
| InChI Key | IBKMZYWDWWIWEL-UHFFFAOYSA-N |
| Molecular Formula | C6H8N2 |
2,3,6-Trifluoro-4-(trifluoromethyl)pyridine, 97%, Thermo Scientific Chemicals
CAS: 84940-46-5 Molecular Formula: C6HF6N Molecular Weight (g/mol): 201.071 MDL Number: MFCD03840203 InChI Key: DODFHNWFNCGXOW-UHFFFAOYSA-N Synonym: 2,3,6-trifluoro-4-trifluoromethyl pyridine,pyridine,2,3,6-trifluoro-4-trifluoromethyl,2,3,6-tris fluoranyl-4-trifluoromethyl pyridine PubChem CID: 2782842 IUPAC Name: 2,3,6-trifluoro-4-(trifluoromethyl)pyridine SMILES: C1=C(C(=C(N=C1F)F)F)C(F)(F)F
| PubChem CID | 2782842 |
|---|---|
| CAS | 84940-46-5 |
| Molecular Weight (g/mol) | 201.071 |
| MDL Number | MFCD03840203 |
| SMILES | C1=C(C(=C(N=C1F)F)F)C(F)(F)F |
| Synonym | 2,3,6-trifluoro-4-trifluoromethyl pyridine,pyridine,2,3,6-trifluoro-4-trifluoromethyl,2,3,6-tris fluoranyl-4-trifluoromethyl pyridine |
| IUPAC Name | 2,3,6-trifluoro-4-(trifluoromethyl)pyridine |
| InChI Key | DODFHNWFNCGXOW-UHFFFAOYSA-N |
| Molecular Formula | C6HF6N |
| CAS | 5444-01-9 |
|---|---|
| MDL Number | MFCD00234272 |
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 |