Organoheterocyclic compounds
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Guanine, 98%, Spectrum™ Chemical
CAS: 73-40-5 Molecular Formula: C5H5N5O Molecular Weight (g/mol): 151.13 MDL Number: MFCD00071533 InChI Key: UYTPUPDQBNUYGX-UHFFFAOYSA-N IUPAC Name: 2-amino-6,7-dihydro-3H-purin-6-one SMILES: NC1=NC(=O)C2=C(N1)N=CN2
| CAS | 73-40-5 |
|---|---|
| Molecular Weight (g/mol) | 151.13 |
| MDL Number | MFCD00071533 |
| SMILES | NC1=NC(=O)C2=C(N1)N=CN2 |
| IUPAC Name | 2-amino-6,7-dihydro-3H-purin-6-one |
| InChI Key | UYTPUPDQBNUYGX-UHFFFAOYSA-N |
| Molecular Formula | C5H5N5O |
(R)-(+)-3-Aminoquinuclidine dihydrochloride, 98%
CAS: 123536-14-1 Molecular Formula: C7H14N2·2ClH Molecular Weight (g/mol): 199.12 MDL Number: MFCD00191752 InChI Key: STZHBULOYDCZET-KLXURFKVSA-N Synonym: r-3-aminoquinuclidine dihydrochloride,r-+-3-aminoquinuclidine dihydrochloride,r-quinuclidin-3-amine dihydrochloride,3r-1-azabicyclo 2.2.2 octan-3-amine dihydrochloride,3r-quinuclidin-3-amine dihydrochloride,r-+-3-aminoquinuclidine 2hcl,3r-3-aminoquinuclidine dihydrochloride,r-1-aza-bicyclo 2.2.2 oct-3-ylamine dihydrochloride,1-azabicyclo 2.2.2 octan-3-amine, dihydrochloride, 3r,pubchem9967 PubChem CID: 12494972 IUPAC Name: (3R)-1-azabicyclo[2.2.2]octan-3-amine;dihydrochloride SMILES: C1CN2CCC1C(C2)N.Cl.Cl
| PubChem CID | 12494972 |
|---|---|
| CAS | 123536-14-1 |
| Molecular Weight (g/mol) | 199.12 |
| MDL Number | MFCD00191752 |
| SMILES | C1CN2CCC1C(C2)N.Cl.Cl |
| Synonym | r-3-aminoquinuclidine dihydrochloride,r-+-3-aminoquinuclidine dihydrochloride,r-quinuclidin-3-amine dihydrochloride,3r-1-azabicyclo 2.2.2 octan-3-amine dihydrochloride,3r-quinuclidin-3-amine dihydrochloride,r-+-3-aminoquinuclidine 2hcl,3r-3-aminoquinuclidine dihydrochloride,r-1-aza-bicyclo 2.2.2 oct-3-ylamine dihydrochloride,1-azabicyclo 2.2.2 octan-3-amine, dihydrochloride, 3r,pubchem9967 |
| IUPAC Name | (3R)-1-azabicyclo[2.2.2]octan-3-amine;dihydrochloride |
| InChI Key | STZHBULOYDCZET-KLXURFKVSA-N |
| Molecular Formula | C7H14N2·2ClH |
Bis(neopentyl glycolato)diboron, 98%
CAS: 201733-56-4 Molecular Formula: C10H20B2O4 Molecular Weight (g/mol): 225.89 MDL Number: MFCD02093062 InChI Key: MDNDJMCSXOXBFZ-UHFFFAOYSA-N Synonym: bis neopentyl glycolato diboron,bis neopentylglycolato diboron,5,5,5',5'-tetramethyl-2,2'-bi 1,3,2-dioxaborinane,2-5,5-dimethyl-1,3,2-dioxaborinan-2-yl-5,5-dimethyl-1,3,2-dioxaborinane,5,5,5',5'-tetramethyl-2,2'-bi-1,3,2-dioxaborinane,2,2'-bi-1,3,2-dioxaborinane, 5,5,5',5'-tetramethyl,bis neopentyl glycolato diborane,bis 2,2-dimethyl-1,3-propanediolato diboron,5,5,5',5'-tetramethyl-2,2' bi 1,3,2 dioxaborinanyl PubChem CID: 2734316 IUPAC Name: 2-(5,5-dimethyl-1,3,2-dioxaborinan-2-yl)-5,5-dimethyl-1,3,2-dioxaborinane SMILES: CC1(C)COB(OC1)B1OCC(C)(C)CO1
| PubChem CID | 2734316 |
|---|---|
| CAS | 201733-56-4 |
| Molecular Weight (g/mol) | 225.89 |
| MDL Number | MFCD02093062 |
| SMILES | CC1(C)COB(OC1)B1OCC(C)(C)CO1 |
| Synonym | bis neopentyl glycolato diboron,bis neopentylglycolato diboron,5,5,5',5'-tetramethyl-2,2'-bi 1,3,2-dioxaborinane,2-5,5-dimethyl-1,3,2-dioxaborinan-2-yl-5,5-dimethyl-1,3,2-dioxaborinane,5,5,5',5'-tetramethyl-2,2'-bi-1,3,2-dioxaborinane,2,2'-bi-1,3,2-dioxaborinane, 5,5,5',5'-tetramethyl,bis neopentyl glycolato diborane,bis 2,2-dimethyl-1,3-propanediolato diboron,5,5,5',5'-tetramethyl-2,2' bi 1,3,2 dioxaborinanyl |
| IUPAC Name | 2-(5,5-dimethyl-1,3,2-dioxaborinan-2-yl)-5,5-dimethyl-1,3,2-dioxaborinane |
| InChI Key | MDNDJMCSXOXBFZ-UHFFFAOYSA-N |
| Molecular Formula | C10H20B2O4 |
2-chloropyridine-3-boronic acid pinacol ester, 97%
CAS: 452972-11-1 Molecular Formula: C11H15BClNO2 Molecular Weight (g/mol): 239.51 MDL Number: MFCD04039873 InChI Key: XFZFMAUUZHBQSS-UHFFFAOYSA-N Synonym: 2-chloropyridine-3-boronic acid pinacol ester,2-chloro-3-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl pyridine,2-chloro-3-4,4,5,5-tetramethyl-1,3,2 dioxaborolan-2-yl-pyridine,2-chloro-3-pyridineboronic acid pinacol ester,2-chloropyridin-3-ylboronic acid pinacol ester,2-chloropyridine-3-boronicacidpinacolester,2-chloropyridine-3-boronic acid, pinacol ester,2-chloro-3-tetramethyl-1,3,2-dioxaborolan-2-yl pyridine,pyridine, 2-chloro-3-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl,pubchem16529 PubChem CID: 12067060 IUPAC Name: 2-chloro-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine SMILES: CC1(C)OB(OC1(C)C)C1=CC=CN=C1Cl
| PubChem CID | 12067060 |
|---|---|
| CAS | 452972-11-1 |
| Molecular Weight (g/mol) | 239.51 |
| MDL Number | MFCD04039873 |
| SMILES | CC1(C)OB(OC1(C)C)C1=CC=CN=C1Cl |
| Synonym | 2-chloropyridine-3-boronic acid pinacol ester,2-chloro-3-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl pyridine,2-chloro-3-4,4,5,5-tetramethyl-1,3,2 dioxaborolan-2-yl-pyridine,2-chloro-3-pyridineboronic acid pinacol ester,2-chloropyridin-3-ylboronic acid pinacol ester,2-chloropyridine-3-boronicacidpinacolester,2-chloropyridine-3-boronic acid, pinacol ester,2-chloro-3-tetramethyl-1,3,2-dioxaborolan-2-yl pyridine,pyridine, 2-chloro-3-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl,pubchem16529 |
| IUPAC Name | 2-chloro-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine |
| InChI Key | XFZFMAUUZHBQSS-UHFFFAOYSA-N |
| Molecular Formula | C11H15BClNO2 |
| CAS | 14906-59-3 |
|---|
| CAS | 6846-35-1 |
|---|
6-Bromo-2-pyridinecarbonitrile, 98%
CAS: 122918-25-6 Molecular Formula: C6H3BrN2 Molecular Weight (g/mol): 183.01 MDL Number: MFCD00234142 InChI Key: HNEBPTAKURBYRM-UHFFFAOYSA-N Synonym: 6-bromopicolinonitrile,6-bromo-2-pyridinecarbonitrile,2-bromo-6-cyanopyridine,6-bromo-2-cyanopyridine,2-pyridinecarbonitrile, 6-bromo,2-cyano-6-bromopyridine,2-bromopyridine-6-carbonitrile,pubchem14367,2-bromo-6-cyanopyridin,2-bromo-6-cyano pyridine PubChem CID: 15100859 IUPAC Name: 6-bromopyridine-2-carbonitrile SMILES: C1=CC(=NC(=C1)Br)C#N
| PubChem CID | 15100859 |
|---|---|
| CAS | 122918-25-6 |
| Molecular Weight (g/mol) | 183.01 |
| MDL Number | MFCD00234142 |
| SMILES | C1=CC(=NC(=C1)Br)C#N |
| Synonym | 6-bromopicolinonitrile,6-bromo-2-pyridinecarbonitrile,2-bromo-6-cyanopyridine,6-bromo-2-cyanopyridine,2-pyridinecarbonitrile, 6-bromo,2-cyano-6-bromopyridine,2-bromopyridine-6-carbonitrile,pubchem14367,2-bromo-6-cyanopyridin,2-bromo-6-cyano pyridine |
| IUPAC Name | 6-bromopyridine-2-carbonitrile |
| InChI Key | HNEBPTAKURBYRM-UHFFFAOYSA-N |
| Molecular Formula | C6H3BrN2 |
| CAS | 614-18-6 |
|---|
1-(2-Aminoethyl)piperazine, 99%
CAS: 140-31-8 Molecular Formula: C6H15N3 Molecular Weight (g/mol): 129.21 MDL Number: MFCD00005971 InChI Key: IMUDHTPIFIBORV-UHFFFAOYSA-N Synonym: n-aminoethylpiperazine,n-2-aminoethyl piperazine,1-2-aminoethyl piperazine,2-piperazin-1-yl ethanamine,1-piperazineethanamine,aminoethylpiperazine,1-piperazineethylamine,1-aminoethylpiperazine,piperazineethanamine,piperazine, 1-2-aminoethyl PubChem CID: 8795 IUPAC Name: 2-piperazin-1-ylethanamine SMILES: NCCN1CCNCC1
| PubChem CID | 8795 |
|---|---|
| CAS | 140-31-8 |
| Molecular Weight (g/mol) | 129.21 |
| MDL Number | MFCD00005971 |
| SMILES | NCCN1CCNCC1 |
| Synonym | n-aminoethylpiperazine,n-2-aminoethyl piperazine,1-2-aminoethyl piperazine,2-piperazin-1-yl ethanamine,1-piperazineethanamine,aminoethylpiperazine,1-piperazineethylamine,1-aminoethylpiperazine,piperazineethanamine,piperazine, 1-2-aminoethyl |
| IUPAC Name | 2-piperazin-1-ylethanamine |
| InChI Key | IMUDHTPIFIBORV-UHFFFAOYSA-N |
| Molecular Formula | C6H15N3 |
2-Methyl-6-nitroquinoline, 97%, Thermo Scientific™
CAS: 613-30-9 Molecular Formula: C10H8N2O2 Molecular Weight (g/mol): 188.19 MDL Number: MFCD00051736 InChI Key: DXDPHHQJZWWAEH-UHFFFAOYSA-N Synonym: 6-nitroquinaldine,quinoline, 2-methyl-6-nitro,maybridge1_001441,acmc-1bb88,1-2-aminoethyl pyrrole-2,5-dione,hydrochloride PubChem CID: 69172 IUPAC Name: 2-methyl-6-nitroquinoline SMILES: CC1=CC=C2C=C(C=CC2=N1)[N+]([O-])=O
| PubChem CID | 69172 |
|---|---|
| CAS | 613-30-9 |
| Molecular Weight (g/mol) | 188.19 |
| MDL Number | MFCD00051736 |
| SMILES | CC1=CC=C2C=C(C=CC2=N1)[N+]([O-])=O |
| Synonym | 6-nitroquinaldine,quinoline, 2-methyl-6-nitro,maybridge1_001441,acmc-1bb88,1-2-aminoethyl pyrrole-2,5-dione,hydrochloride |
| IUPAC Name | 2-methyl-6-nitroquinoline |
| InChI Key | DXDPHHQJZWWAEH-UHFFFAOYSA-N |
| Molecular Formula | C10H8N2O2 |
| CAS | 5144-89-8 |
|---|
2-([7-(acetylamino)-6-(benzyloxy)-2-phenylperhydropyrano[3,2-d][1,3]dioxin-8-yl]oxy)propanoic acid, Thermo Scientific™
CAS: 499104-69-7 Molecular Formula: C25H29NO8 Molecular Weight (g/mol): 471.506 InChI Key: JPPMVSNCFXDOJX-UHFFFAOYSA-N Synonym: 2-7-acetylamino-6-benzyloxy-2-phenylperhydropyrano 3,2-d 1,3 dioxin-8-yl oxy propanoic acid,2r-2-4ar,6s,7r,8r,8as-7-acetamido-6-benzyloxy-2-phenylhexahydropyrano 3,2-d 1,3 dioxin-8-yl oxy propanoic acid,2-6-benzyloxy-7-acetamido-2-phenyl-hexahydro-2h-pyrano 3,2-d 1,3 dioxin-8-yl oxy propanoic acid,benzyl n-acetyl-4,6-o-benzylidenemuramic acid,2-7-acetamido-6-benzyloxy-2-phenylhexahydropyrano 3,2-d 1,3 dioxin-8-yl oxy propanoic acid,2-7-acetamido-2-phenyl-6-phenylmethoxy-4,4a,6,7,8,8a-hexahydropyrano 3,2-d 1,3 dioxin-8-yl oxy propanoic acid PubChem CID: 3843768 IUPAC Name: 2-[(7-acetamido-2-phenyl-6-phenylmethoxy-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-8-yl)oxy]propanoic acid SMILES: CC(C(=O)O)OC1C(C(OC2C1OC(OC2)C3=CC=CC=C3)OCC4=CC=CC=C4)NC(=O)C
| PubChem CID | 3843768 |
|---|---|
| CAS | 499104-69-7 |
| Molecular Weight (g/mol) | 471.506 |
| SMILES | CC(C(=O)O)OC1C(C(OC2C1OC(OC2)C3=CC=CC=C3)OCC4=CC=CC=C4)NC(=O)C |
| Synonym | 2-7-acetylamino-6-benzyloxy-2-phenylperhydropyrano 3,2-d 1,3 dioxin-8-yl oxy propanoic acid,2r-2-4ar,6s,7r,8r,8as-7-acetamido-6-benzyloxy-2-phenylhexahydropyrano 3,2-d 1,3 dioxin-8-yl oxy propanoic acid,2-6-benzyloxy-7-acetamido-2-phenyl-hexahydro-2h-pyrano 3,2-d 1,3 dioxin-8-yl oxy propanoic acid,benzyl n-acetyl-4,6-o-benzylidenemuramic acid,2-7-acetamido-6-benzyloxy-2-phenylhexahydropyrano 3,2-d 1,3 dioxin-8-yl oxy propanoic acid,2-7-acetamido-2-phenyl-6-phenylmethoxy-4,4a,6,7,8,8a-hexahydropyrano 3,2-d 1,3 dioxin-8-yl oxy propanoic acid |
| IUPAC Name | 2-[(7-acetamido-2-phenyl-6-phenylmethoxy-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-8-yl)oxy]propanoic acid |
| InChI Key | JPPMVSNCFXDOJX-UHFFFAOYSA-N |
| Molecular Formula | C25H29NO8 |
2-methyl-1,3-oxazole-4-carboxylic acid, Thermo Scientific™
CAS: 23062-17-1 Molecular Formula: C5H5NO3 Molecular Weight (g/mol): 127.099 InChI Key: IARMCEYEYXXEOS-UHFFFAOYSA-N Synonym: 2-methyloxazole-4-carboxylic acid,2-methyl-oxazole-4-carboxylic acid,4-oxazolecarboxylic acid, 2-methyl,4-carboxy-2-methyl-1,3-oxazole,2-methyloxa,oxazole-4-carboxylic acid, 2-methyl,2-methyloxazol-4-carboxylic acid,4-oxazolecarboxylicacid, 2-methyl,2-methyl-3h-isoxazole-4-carboxylic acid,2-methyl-4-oxazolecarboxylic acid PubChem CID: 539404 IUPAC Name: 2-methyl-1,3-oxazole-4-carboxylic acid SMILES: CC1=NC(=CO1)C(=O)O
| PubChem CID | 539404 |
|---|---|
| CAS | 23062-17-1 |
| Molecular Weight (g/mol) | 127.099 |
| SMILES | CC1=NC(=CO1)C(=O)O |
| Synonym | 2-methyloxazole-4-carboxylic acid,2-methyl-oxazole-4-carboxylic acid,4-oxazolecarboxylic acid, 2-methyl,4-carboxy-2-methyl-1,3-oxazole,2-methyloxa,oxazole-4-carboxylic acid, 2-methyl,2-methyloxazol-4-carboxylic acid,4-oxazolecarboxylicacid, 2-methyl,2-methyl-3h-isoxazole-4-carboxylic acid,2-methyl-4-oxazolecarboxylic acid |
| IUPAC Name | 2-methyl-1,3-oxazole-4-carboxylic acid |
| InChI Key | IARMCEYEYXXEOS-UHFFFAOYSA-N |
| Molecular Formula | C5H5NO3 |
2-(5-Methyl-2-phenyl-1,3-oxazol-4-yl)acetic acid, 97%, Thermo Scientific™
CAS: 107367-98-6 Molecular Formula: C12H11NO3 Molecular Weight (g/mol): 217.224 MDL Number: MFCD00100005 InChI Key: XEWJNPORMBGGKZ-UHFFFAOYSA-N Synonym: 2-5-methyl-2-phenyl-1,3-oxazol-4-yl acetic acid,5-methyl-2-phenyl-1,3-oxazol-4-yl acetic acid,2-5-methyl-2-phenyloxazol-4-yl acetic acid,5-methyl-2-phenyloxazol-4-yl acetic acid,maybridge1_002118,acmc-2098vv,2-phenyl-5-methyl-4-oxazolyiacetic acid,2-phenyl-5-methyl-4-oxazolylacetic acid,2-phenyl-5-methyloxazol-4-ylacetic acid,5-methyl-2-phenyl-1,3-oxazolyl acetic acid PubChem CID: 2775139 IUPAC Name: 2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)acetic acid SMILES: CC1=C(N=C(O1)C2=CC=CC=C2)CC(=O)O
| PubChem CID | 2775139 |
|---|---|
| CAS | 107367-98-6 |
| Molecular Weight (g/mol) | 217.224 |
| MDL Number | MFCD00100005 |
| SMILES | CC1=C(N=C(O1)C2=CC=CC=C2)CC(=O)O |
| Synonym | 2-5-methyl-2-phenyl-1,3-oxazol-4-yl acetic acid,5-methyl-2-phenyl-1,3-oxazol-4-yl acetic acid,2-5-methyl-2-phenyloxazol-4-yl acetic acid,5-methyl-2-phenyloxazol-4-yl acetic acid,maybridge1_002118,acmc-2098vv,2-phenyl-5-methyl-4-oxazolyiacetic acid,2-phenyl-5-methyl-4-oxazolylacetic acid,2-phenyl-5-methyloxazol-4-ylacetic acid,5-methyl-2-phenyl-1,3-oxazolyl acetic acid |
| IUPAC Name | 2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)acetic acid |
| InChI Key | XEWJNPORMBGGKZ-UHFFFAOYSA-N |
| Molecular Formula | C12H11NO3 |
5-(2-Bromophenyl)-1,3-oxazole, ≥97%, Thermo Scientific™
CAS: 328270-70-8 Molecular Formula: C9H6BrNO Molecular Weight (g/mol): 224.057 MDL Number: MFCD05668985 InChI Key: JLTHLCLAPCIKJJ-UHFFFAOYSA-N Synonym: 5-2-bromophenyl oxazole,5-2-bromophenyl-1,3-oxazole,oxazole,5-2-bromophenyl PubChem CID: 3780551 IUPAC Name: 5-(2-bromophenyl)-1,3-oxazole SMILES: C1=CC=C(C(=C1)C2=CN=CO2)Br
| PubChem CID | 3780551 |
|---|---|
| CAS | 328270-70-8 |
| Molecular Weight (g/mol) | 224.057 |
| MDL Number | MFCD05668985 |
| SMILES | C1=CC=C(C(=C1)C2=CN=CO2)Br |
| Synonym | 5-2-bromophenyl oxazole,5-2-bromophenyl-1,3-oxazole,oxazole,5-2-bromophenyl |
| IUPAC Name | 5-(2-bromophenyl)-1,3-oxazole |
| InChI Key | JLTHLCLAPCIKJJ-UHFFFAOYSA-N |
| Molecular Formula | C9H6BrNO |