
Organoheterocyclic compounds






























































































































Filtered Search Results

5-Iodo-1H-indazole, 95%
CAS: 55919-82-9 Molecular Formula: C7H5IN2 Molecular Weight (g/mol): 244.03 MDL Number: MFCD07781642 InChI Key: CGCHCLICSHIAAM-UHFFFAOYSA-N Synonym: 5-iodoindazole,1h-indazole, 5-iodo,5-iodo 1h indazole,5-iodanyl-1h-indazole,5-iodio-1h-indazole,pubchem20575,d07ovy,indazole, 5-iodo,5-iodo-1h-indazole PubChem CID: 21894739 IUPAC Name: 5-iodo-1H-indazole SMILES: C1=CC2=C(C=C1I)C=NN2

PubChem CID | 21894739 |
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CAS | 55919-82-9 |
Molecular Weight (g/mol) | 244.03 |
MDL Number | MFCD07781642 |
SMILES | C1=CC2=C(C=C1I)C=NN2 |
Synonym | 5-iodoindazole,1h-indazole, 5-iodo,5-iodo 1h indazole,5-iodanyl-1h-indazole,5-iodio-1h-indazole,pubchem20575,d07ovy,indazole, 5-iodo,5-iodo-1h-indazole |
IUPAC Name | 5-iodo-1H-indazole |
InChI Key | CGCHCLICSHIAAM-UHFFFAOYSA-N |
Molecular Formula | C7H5IN2 |
6-Bromonicotinic acid, 96%
CAS: 6311-35-9 Molecular Formula: C6H4BrNO2 Molecular Weight (g/mol): 202.01 MDL Number: MFCD01927100 InChI Key: JDJBRMNTXORYEN-UHFFFAOYSA-N Synonym: 6-bromonicotinic acid,6-bromo nicotinic acid,2-bromo-5-pyridinecarboxylic acid,2-bromopyridine-5-carboxylic acid,6-bromo-3-pyridine carboxylic acid,6-bromonicotinicacid,6-bromo-nicotinic acid,6-bromo-3-pyridinecarboxylic acid,2-bromo-5-pyridine carboxylic acid,3-pyridinecarboxylic acid, 6-bromo PubChem CID: 238932 IUPAC Name: 6-bromopyridine-3-carboxylic acid SMILES: OC(=O)C1=CC=C(Br)N=C1

PubChem CID | 238932 |
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CAS | 6311-35-9 |
Molecular Weight (g/mol) | 202.01 |
MDL Number | MFCD01927100 |
SMILES | OC(=O)C1=CC=C(Br)N=C1 |
Synonym | 6-bromonicotinic acid,6-bromo nicotinic acid,2-bromo-5-pyridinecarboxylic acid,2-bromopyridine-5-carboxylic acid,6-bromo-3-pyridine carboxylic acid,6-bromonicotinicacid,6-bromo-nicotinic acid,6-bromo-3-pyridinecarboxylic acid,2-bromo-5-pyridine carboxylic acid,3-pyridinecarboxylic acid, 6-bromo |
IUPAC Name | 6-bromopyridine-3-carboxylic acid |
InChI Key | JDJBRMNTXORYEN-UHFFFAOYSA-N |
Molecular Formula | C6H4BrNO2 |
6-Hydroxyquinoline, 98%
CAS: 580-16-5 Molecular Formula: C9H7NO Molecular Weight (g/mol): 145.16 MDL Number: MFCD00047611 InChI Key: OVYWMEWYEJLIER-UHFFFAOYSA-N Synonym: 6-hydroxyquinoline,6-quinolinol,1h-1,6-epoxyquinoline,ccris 4331,6-chinolinol,6-hydroxyquinoline 6-quinolinol,quinoline-6-ol,6-quinolinoloxine,6-hydroxy-chinolin,6-hydroxy-quinoline PubChem CID: 11374 ChEBI: CHEBI:48994 IUPAC Name: quinolin-6-ol SMILES: C1=CC2=C(C=CC(=C2)O)N=C1

PubChem CID | 11374 |
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CAS | 580-16-5 |
Molecular Weight (g/mol) | 145.16 |
ChEBI | CHEBI:48994 |
MDL Number | MFCD00047611 |
SMILES | C1=CC2=C(C=CC(=C2)O)N=C1 |
Synonym | 6-hydroxyquinoline,6-quinolinol,1h-1,6-epoxyquinoline,ccris 4331,6-chinolinol,6-hydroxyquinoline 6-quinolinol,quinoline-6-ol,6-quinolinoloxine,6-hydroxy-chinolin,6-hydroxy-quinoline |
IUPAC Name | quinolin-6-ol |
InChI Key | OVYWMEWYEJLIER-UHFFFAOYSA-N |
Molecular Formula | C9H7NO |
2-Aminobenzothiazole, 97%
CAS: 136-95-8 Molecular Formula: C7H6N2S Molecular Weight (g/mol): 150.2 MDL Number: MFCD00005785 InChI Key: UHGULLIUJBCTEF-UHFFFAOYSA-N Synonym: 2-aminobenzothiazole,2-benzothiazolamine,benzo d thiazol-2-amine,benzothiazol-2-ylamine,2-aminobenzthiazole,benzothiazole-2-ylamine,2-iminobenzothiazoline,o-aminobenzothiazole,benzothiazole, 2-amino,2-benzothiazolylamine PubChem CID: 8706 IUPAC Name: 1,3-benzothiazol-2-amine SMILES: C1=CC=C2C(=C1)N=C(S2)N

PubChem CID | 8706 |
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CAS | 136-95-8 |
Molecular Weight (g/mol) | 150.2 |
MDL Number | MFCD00005785 |
SMILES | C1=CC=C2C(=C1)N=C(S2)N |
Synonym | 2-aminobenzothiazole,2-benzothiazolamine,benzo d thiazol-2-amine,benzothiazol-2-ylamine,2-aminobenzthiazole,benzothiazole-2-ylamine,2-iminobenzothiazoline,o-aminobenzothiazole,benzothiazole, 2-amino,2-benzothiazolylamine |
IUPAC Name | 1,3-benzothiazol-2-amine |
InChI Key | UHGULLIUJBCTEF-UHFFFAOYSA-N |
Molecular Formula | C7H6N2S |
3-Quinolinecarboxylic acid, 98%
CAS: 6480-68-8 Molecular Formula: C10H7NO2 Molecular Weight (g/mol): 173.17 MDL Number: MFCD00006770 InChI Key: DJXNJVFEFSWHLY-UHFFFAOYSA-N Synonym: 3-quinolinecarboxylic acid,3-quinoline carboxylic acid,3-quinolinecarboxylicacid,pubchem7517,3-quinolylcarboxylic acid,acmc-1bfc6,3-quinolinecarboxylic acid 1g,3-quinolinecarboxylic acid, purum hplc,q3c PubChem CID: 80971 IUPAC Name: quinoline-3-carboxylic acid SMILES: C1=CC=C2C(=C1)C=C(C=N2)C(=O)O

PubChem CID | 80971 |
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CAS | 6480-68-8 |
Molecular Weight (g/mol) | 173.17 |
MDL Number | MFCD00006770 |
SMILES | C1=CC=C2C(=C1)C=C(C=N2)C(=O)O |
Synonym | 3-quinolinecarboxylic acid,3-quinoline carboxylic acid,3-quinolinecarboxylicacid,pubchem7517,3-quinolylcarboxylic acid,acmc-1bfc6,3-quinolinecarboxylic acid 1g,3-quinolinecarboxylic acid, purum hplc,q3c |
IUPAC Name | quinoline-3-carboxylic acid |
InChI Key | DJXNJVFEFSWHLY-UHFFFAOYSA-N |
Molecular Formula | C10H7NO2 |
2,5-Dimethylfuran, 99%
CAS: 625-86-5 Molecular Formula: C6H8O Molecular Weight (g/mol): 96.13 MDL Number: MFCD00003250 InChI Key: GSNUFIFRDBKVIE-UHFFFAOYSA-N Synonym: furan, 2,5-dimethyl,2,5-dimethylfurane,2,5-dimethyl-furan,2,5-dimethyl furane,unii-dr5hl9oj7y,ccris 3158,2,5-dimethyl furan,dr5hl9oj7y,2.5-dimethyl furan,acmc-1avpg PubChem CID: 12266 IUPAC Name: 2,5-dimethylfuran SMILES: CC1=CC=C(O1)C

PubChem CID | 12266 |
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CAS | 625-86-5 |
Molecular Weight (g/mol) | 96.13 |
MDL Number | MFCD00003250 |
SMILES | CC1=CC=C(O1)C |
Synonym | furan, 2,5-dimethyl,2,5-dimethylfurane,2,5-dimethyl-furan,2,5-dimethyl furane,unii-dr5hl9oj7y,ccris 3158,2,5-dimethyl furan,dr5hl9oj7y,2.5-dimethyl furan,acmc-1avpg |
IUPAC Name | 2,5-dimethylfuran |
InChI Key | GSNUFIFRDBKVIE-UHFFFAOYSA-N |
Molecular Formula | C6H8O |
1,2-Epoxyhexane, 97%
CAS: 1436-34-6 Molecular Formula: C6H12O Molecular Weight (g/mol): 100.16 MDL Number: MFCD00005154 InChI Key: WHNBDXQTMPYBAT-UHFFFAOYSA-N Synonym: 1,2-epoxyhexane,butyloxirane,oxirane, butyl,1-hexene oxide,1-hexene epoxide,1,2-hexene oxide,epoxy-n-hexane,hexylene oxide,hexane, 1,2-epoxy,hexene, monooxide PubChem CID: 15036 IUPAC Name: 2-butyloxirane SMILES: CCCCC1CO1

PubChem CID | 15036 |
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CAS | 1436-34-6 |
Molecular Weight (g/mol) | 100.16 |
MDL Number | MFCD00005154 |
SMILES | CCCCC1CO1 |
Synonym | 1,2-epoxyhexane,butyloxirane,oxirane, butyl,1-hexene oxide,1-hexene epoxide,1,2-hexene oxide,epoxy-n-hexane,hexylene oxide,hexane, 1,2-epoxy,hexene, monooxide |
IUPAC Name | 2-butyloxirane |
InChI Key | WHNBDXQTMPYBAT-UHFFFAOYSA-N |
Molecular Formula | C6H12O |
Benzo[b]furan-2-carboxylic acid, 98%
CAS: 496-41-3 Molecular Formula: C9H6O3 Molecular Weight (g/mol): 162.14 MDL Number: MFCD00005848 InChI Key: OFFSPAZVIVZPHU-UHFFFAOYSA-N Synonym: benzofuran-2-carboxylic acid,coumarilic acid,benzo b furan-2-carboxylic acid,2-benzofurancarboxylic acid,2-carboxybenzofuran,coumarone-2-carboxylic acid,unii-7z6nmg947l,chembl84095,benzofuran-2-carboxylicacid PubChem CID: 10331 IUPAC Name: 1-benzofuran-2-carboxylic acid SMILES: OC(=O)C1=CC2=CC=CC=C2O1

PubChem CID | 10331 |
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CAS | 496-41-3 |
Molecular Weight (g/mol) | 162.14 |
MDL Number | MFCD00005848 |
SMILES | OC(=O)C1=CC2=CC=CC=C2O1 |
Synonym | benzofuran-2-carboxylic acid,coumarilic acid,benzo b furan-2-carboxylic acid,2-benzofurancarboxylic acid,2-carboxybenzofuran,coumarone-2-carboxylic acid,unii-7z6nmg947l,chembl84095,benzofuran-2-carboxylicacid |
IUPAC Name | 1-benzofuran-2-carboxylic acid |
InChI Key | OFFSPAZVIVZPHU-UHFFFAOYSA-N |
Molecular Formula | C9H6O3 |
2-Mercaptopyridine-N-oxide, sodium salt, 40 w/w % aqueous solution
CAS: 3811-73-2 | C5H4NNaOS | 149.15 g/mol

Molecular Weight (g/mol) | 149.15 |
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CAS Min % | 58.0 |
InChI Key | XNRNJIIJLOFJEK-UHFFFAOYSA-N |
Density | 1.2200g/mL |
PubChem CID | 19658 |
Name Note | 40 w/w% Aqueous Solution |
Percent Purity | 40 to 42% |
pH | 8.5 to 10.5 (10% soln. at 20°C) |
Formula Weight | 149.15 |
Melting Point | -30.0°C |
CAS Max % | 60.0 |
Boiling Point | 109.0°C |
Physical Form | Solution |
Chemical Name or Material | 2-Mercaptopyridine-N-oxide, sodium salt |
SMILES | C1=CC(=S)N(C=C1)[O-].[Na+] |
Merck Index | 10, 7892 |
CAS | 7732-18-5 |
Health Hazard 3 | GHS P Statement Wear protective gloves/protective clothing/eye protection/face protection. IF SWALLOWED: rinse mouth. Do NOT induce vomiting. Call a POISON CENTER or doctor/physician if you feel unwell. IF ON SKIN: Wash with plen |
MDL Number | MFCD01941547 |
Health Hazard 2 | GHS H Statement Harmful if swallowed. Harmful in contact with skin. Harmful if inhaled. Causes skin irritation. Causes serious eye irritation. Very toxic to aquatic life with long lasting effects. |
Solubility Information | Solubility in water: soluble |
Health Hazard 1 | GHS Signal Word: Warning |
Synonym | sodium omadine,sodium pyrithione,sodium 2-pyridylthio-n-oxide,pyrithione sodium salt,thione reagent,2-pyridinethiol-1-oxide sodium salt,2-mercaptopyridine n-oxide sodium salt,omadine sodium,sodium-2-pyridinethiol-1-oxide,sodium omadine van |
IUPAC Name | sodium;1-oxidopyridine-2-thione |
Molecular Formula | C5H4NNaOS |
EINECS Number | 223-296-5 |
Specific Gravity | 1.22 |
2-Amino-3-nitro-4-picoline, 98%, Thermo Scientific™
CAS: 6635-86-5 Molecular Formula: C6H7N3O2 Molecular Weight (g/mol): 153.14 MDL Number: MFCD00006315 InChI Key: IKMZGACFMXZAAT-UHFFFAOYSA-N Synonym: 2-amino-4-methyl-3-nitropyridine,2-amino-3-nitro-4-picoline,2-pyridinamine, 4-methyl-3-nitro,2-amino-3-nitro-4-methylpyridine,4-methyl-3-nitro-pyridin-2-ylamine,4-methyl-3-nitro-2-pyridylamine,4-methyl-3-nitro-2-pyridinamine,4-methyl-3-nitro-2-aminopyridine,4-methyl-3-nitropyridin-2-amin,4mrz PubChem CID: 243166 IUPAC Name: 4-methyl-3-nitropyridin-2-amine SMILES: CC1=C(C(=NC=C1)N)[N+](=O)[O-]

PubChem CID | 243166 |
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CAS | 6635-86-5 |
Molecular Weight (g/mol) | 153.14 |
MDL Number | MFCD00006315 |
SMILES | CC1=C(C(=NC=C1)N)[N+](=O)[O-] |
Synonym | 2-amino-4-methyl-3-nitropyridine,2-amino-3-nitro-4-picoline,2-pyridinamine, 4-methyl-3-nitro,2-amino-3-nitro-4-methylpyridine,4-methyl-3-nitro-pyridin-2-ylamine,4-methyl-3-nitro-2-pyridylamine,4-methyl-3-nitro-2-pyridinamine,4-methyl-3-nitro-2-aminopyridine,4-methyl-3-nitropyridin-2-amin,4mrz |
IUPAC Name | 4-methyl-3-nitropyridin-2-amine |
InChI Key | IKMZGACFMXZAAT-UHFFFAOYSA-N |
Molecular Formula | C6H7N3O2 |
2-Thiopheneacetic acid, 98%
CAS: 1918-77-0 MDL Number: MFCD00005458 InChI Key: SMJRBWINMFUUDS-UHFFFAOYSA-N Synonym: 2-thiopheneacetic acid,2-thienylacetic acid,thiopheneacetic acid,2-thiophen-2-yl acetic acid,thiophene-2-acetic acid,2-2-thienyl acetic acid,2-thiophene acetic acid,thiophen-2-ylacetic acid,thien-2-yl acetic acid,2-carboxymethyl thiophene PubChem CID: 15970 ChEBI: CHEBI:45807 IUPAC Name: 2-thiophen-2-ylacetic acid SMILES: C1=CSC(=C1)CC(=O)O

PubChem CID | 15970 |
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CAS | 1918-77-0 |
ChEBI | CHEBI:45807 |
MDL Number | MFCD00005458 |
SMILES | C1=CSC(=C1)CC(=O)O |
Synonym | 2-thiopheneacetic acid,2-thienylacetic acid,thiopheneacetic acid,2-thiophen-2-yl acetic acid,thiophene-2-acetic acid,2-2-thienyl acetic acid,2-thiophene acetic acid,thiophen-2-ylacetic acid,thien-2-yl acetic acid,2-carboxymethyl thiophene |
IUPAC Name | 2-thiophen-2-ylacetic acid |
InChI Key | SMJRBWINMFUUDS-UHFFFAOYSA-N |
4-Amino-1-benzylpiperidine, 98%
CAS: 50541-93-0 Molecular Formula: C12H18N2 Molecular Weight (g/mol): 190.29 MDL Number: MFCD00006504 InChI Key: YUBDLZGUSSWQSS-UHFFFAOYSA-N Synonym: 4-amino-1-benzylpiperidine,1-benzyl-4-aminopiperidine,1-benzyl-piperidin-4-ylamine,n-benzyl-4-amino piperidine,1-benzyl-4-piperidylamine,4-piperidinamine, 1-phenylmethyl,4-amino-1-n-benzylpiperidine,4-amino-n-benzylpiperidine,1-phenylmethyl-4-piperidinamine,n-benzyl-4-aminopiperidine PubChem CID: 415852 IUPAC Name: 1-benzylpiperidin-4-amine SMILES: C1CN(CCC1N)CC2=CC=CC=C2

PubChem CID | 415852 |
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CAS | 50541-93-0 |
Molecular Weight (g/mol) | 190.29 |
MDL Number | MFCD00006504 |
SMILES | C1CN(CCC1N)CC2=CC=CC=C2 |
Synonym | 4-amino-1-benzylpiperidine,1-benzyl-4-aminopiperidine,1-benzyl-piperidin-4-ylamine,n-benzyl-4-amino piperidine,1-benzyl-4-piperidylamine,4-piperidinamine, 1-phenylmethyl,4-amino-1-n-benzylpiperidine,4-amino-n-benzylpiperidine,1-phenylmethyl-4-piperidinamine,n-benzyl-4-aminopiperidine |
IUPAC Name | 1-benzylpiperidin-4-amine |
InChI Key | YUBDLZGUSSWQSS-UHFFFAOYSA-N |
Molecular Formula | C12H18N2 |
5-Amino-4,6-dichloropyrimidine, 97%
CAS: 5413-85-4 Molecular Formula: C4H3Cl2N3 Molecular Weight (g/mol): 163.99 MDL Number: MFCD00006108 InChI Key: NIGDWBHWHVHOAD-UHFFFAOYSA-N Synonym: 5-amino-4,6-dichloropyrimidine,5-pyrimidinamine, 4,6-dichloro,4,6-dichloro-5-pyrimidinamine,4,6-dichloro-5-aminopyrimidine,4,6-dichloropyrimidin-5-ylamine,5-amine-4,6-dichloropyrimidine,5-amino-4,6-dichloropyfimidine,4,6-dichloro-pyrimidin-5-ylamine,pyrimidine, 5-amino-4,6-dichloro,4,6-dichloropyrimidine-5-ylamine PubChem CID: 79434 IUPAC Name: 4,6-dichloropyrimidin-5-amine SMILES: NC1=C(Cl)N=CN=C1Cl

PubChem CID | 79434 |
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CAS | 5413-85-4 |
Molecular Weight (g/mol) | 163.99 |
MDL Number | MFCD00006108 |
SMILES | NC1=C(Cl)N=CN=C1Cl |
Synonym | 5-amino-4,6-dichloropyrimidine,5-pyrimidinamine, 4,6-dichloro,4,6-dichloro-5-pyrimidinamine,4,6-dichloro-5-aminopyrimidine,4,6-dichloropyrimidin-5-ylamine,5-amine-4,6-dichloropyrimidine,5-amino-4,6-dichloropyfimidine,4,6-dichloro-pyrimidin-5-ylamine,pyrimidine, 5-amino-4,6-dichloro,4,6-dichloropyrimidine-5-ylamine |
IUPAC Name | 4,6-dichloropyrimidin-5-amine |
InChI Key | NIGDWBHWHVHOAD-UHFFFAOYSA-N |
Molecular Formula | C4H3Cl2N3 |
Ethyl isodehydroacetate, 95%, Thermo Scientific™
CAS: 3385-34-0 Molecular Formula: C10H12O4 Molecular Weight (g/mol): 196.20 MDL Number: MFCD00006643 InChI Key: FBPWNVQUVXSXKS-UHFFFAOYSA-N Synonym: ethyl isodehydroacetate,ethyl 4,6-dimethyl-2-oxo-2h-pyran-5-carboxylate,ethyl isodehydracetate,5-carbethoxy-4,6-dimethyl-2-pyrone,2h-pyran-5-carboxylic acid, 4,6-dimethyl-2-oxo-, ethyl ester,ethyl 4,6-dimethyl-5-coumalate,2,4-dimethyl-6-oxo-6h-pyran-3-carboxylic acid ethyl ester,ethylisodehydroacetate,ethyl 4,6-dimethyl-2-oxopyran-5-carboxylate,acmc-20am57 PubChem CID: 76918 IUPAC Name: ethyl 2,4-dimethyl-6-oxopyran-3-carboxylate SMILES: CCOC(=O)C1=C(C)OC(=O)C=C1C

PubChem CID | 76918 |
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CAS | 3385-34-0 |
Molecular Weight (g/mol) | 196.20 |
MDL Number | MFCD00006643 |
SMILES | CCOC(=O)C1=C(C)OC(=O)C=C1C |
Synonym | ethyl isodehydroacetate,ethyl 4,6-dimethyl-2-oxo-2h-pyran-5-carboxylate,ethyl isodehydracetate,5-carbethoxy-4,6-dimethyl-2-pyrone,2h-pyran-5-carboxylic acid, 4,6-dimethyl-2-oxo-, ethyl ester,ethyl 4,6-dimethyl-5-coumalate,2,4-dimethyl-6-oxo-6h-pyran-3-carboxylic acid ethyl ester,ethylisodehydroacetate,ethyl 4,6-dimethyl-2-oxopyran-5-carboxylate,acmc-20am57 |
IUPAC Name | ethyl 2,4-dimethyl-6-oxopyran-3-carboxylate |
InChI Key | FBPWNVQUVXSXKS-UHFFFAOYSA-N |
Molecular Formula | C10H12O4 |