Organoheterocyclic compounds
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2,4-Dihydroxypyridine, 97%
CAS: 626-03-9 Molecular Formula: C5H5NO2 Molecular Weight (g/mol): 111.1 MDL Number: MFCD00006273 InChI Key: ZEZJPIDPVXJEME-UHFFFAOYSA-N Synonym: 2,4-dihydroxypyridine,pyridine-2,4-diol,2,4-pyridinediol,4-hydroxypyridin-2 1h-one,3-deazauracil,4-hydroxy-2-pyridone,2 1h-pyridinone, 4-hydroxy,2,4-dihydroxy pyridine,2-hydroxy-1h-pyridin-4-one,4-hydroxy-2 1h-pyridinone PubChem CID: 54696004 IUPAC Name: 4-hydroxy-1H-pyridin-2-one SMILES: C1=CNC(=O)C=C1O
| PubChem CID | 54696004 |
|---|---|
| CAS | 626-03-9 |
| Molecular Weight (g/mol) | 111.1 |
| MDL Number | MFCD00006273 |
| SMILES | C1=CNC(=O)C=C1O |
| Synonym | 2,4-dihydroxypyridine,pyridine-2,4-diol,2,4-pyridinediol,4-hydroxypyridin-2 1h-one,3-deazauracil,4-hydroxy-2-pyridone,2 1h-pyridinone, 4-hydroxy,2,4-dihydroxy pyridine,2-hydroxy-1h-pyridin-4-one,4-hydroxy-2 1h-pyridinone |
| IUPAC Name | 4-hydroxy-1H-pyridin-2-one |
| InChI Key | ZEZJPIDPVXJEME-UHFFFAOYSA-N |
| Molecular Formula | C5H5NO2 |
Quinoxaline, 98+%
CAS: 91-19-0 Molecular Formula: C8H6N2 Molecular Weight (g/mol): 130.15 MDL Number: MFCD00006719 InChI Key: XSCHRSMBECNVNS-UHFFFAOYSA-N Synonym: benzoparadiazine,1,4-benzodiazine,phenopiazine,phenpiazine,quinazine,benzopyrazine,1,4-diazanaphthalene,benzo a pyrazine,1,4-naphthyridine,chinoxalin PubChem CID: 7045 ChEBI: CHEBI:36616 IUPAC Name: quinoxaline SMILES: C1=CC=C2C(=C1)N=CC=N2
| PubChem CID | 7045 |
|---|---|
| CAS | 91-19-0 |
| Molecular Weight (g/mol) | 130.15 |
| ChEBI | CHEBI:36616 |
| MDL Number | MFCD00006719 |
| SMILES | C1=CC=C2C(=C1)N=CC=N2 |
| Synonym | benzoparadiazine,1,4-benzodiazine,phenopiazine,phenpiazine,quinazine,benzopyrazine,1,4-diazanaphthalene,benzo a pyrazine,1,4-naphthyridine,chinoxalin |
| IUPAC Name | quinoxaline |
| InChI Key | XSCHRSMBECNVNS-UHFFFAOYSA-N |
| Molecular Formula | C8H6N2 |
1,3-Benzodioxole, 99%
CAS: 274-09-9 Molecular Formula: C7H6O2 Molecular Weight (g/mol): 122.123 MDL Number: MFCD00005818 InChI Key: FTNJQNQLEGKTGD-UHFFFAOYSA-N Synonym: 1,2-methylenedioxybenzene,benzodioxole,benzo d 1,3 dioxole,1,3-dioxaindan,3,4-methylenedioxybenzene,2h-1,3-benzodioxole,1,2-methylenedioxy benzene,1,3-dioxindan,methylenedioxybenzene,o-methylenedioxy benzene PubChem CID: 9229 ChEBI: CHEBI:38732 IUPAC Name: 1,3-benzodioxole SMILES: C1OC2=CC=CC=C2O1
| PubChem CID | 9229 |
|---|---|
| CAS | 274-09-9 |
| Molecular Weight (g/mol) | 122.123 |
| ChEBI | CHEBI:38732 |
| MDL Number | MFCD00005818 |
| SMILES | C1OC2=CC=CC=C2O1 |
| Synonym | 1,2-methylenedioxybenzene,benzodioxole,benzo d 1,3 dioxole,1,3-dioxaindan,3,4-methylenedioxybenzene,2h-1,3-benzodioxole,1,2-methylenedioxy benzene,1,3-dioxindan,methylenedioxybenzene,o-methylenedioxy benzene |
| IUPAC Name | 1,3-benzodioxole |
| InChI Key | FTNJQNQLEGKTGD-UHFFFAOYSA-N |
| Molecular Formula | C7H6O2 |
2-Fluoro-4-hydroxypyridine, 97%
CAS: 22282-69-5 Molecular Formula: C5H4FNO Molecular Weight (g/mol): 113.091 MDL Number: MFCD04114159 InChI Key: BRLSDLHMGRDAPF-UHFFFAOYSA-N Synonym: 2-fluoropyridin-4-ol,2-fluoro-4-hydroxypyridine,2-fluoro-pyridin-4-ol,4-pyridinol, 2-fluoro,2-fluoro-4-pyridinol,4 1h-pyridinone,2-fluoro,2-fluoranyl-1h-pyridin-4-one,4 1h-pyridinone, 2-fluoro,4 1h-pyridinone, 2-fluoro-9ci PubChem CID: 2762834 IUPAC Name: 2-fluoro-1H-pyridin-4-one SMILES: C1=CNC(=CC1=O)F
| PubChem CID | 2762834 |
|---|---|
| CAS | 22282-69-5 |
| Molecular Weight (g/mol) | 113.091 |
| MDL Number | MFCD04114159 |
| SMILES | C1=CNC(=CC1=O)F |
| Synonym | 2-fluoropyridin-4-ol,2-fluoro-4-hydroxypyridine,2-fluoro-pyridin-4-ol,4-pyridinol, 2-fluoro,2-fluoro-4-pyridinol,4 1h-pyridinone,2-fluoro,2-fluoranyl-1h-pyridin-4-one,4 1h-pyridinone, 2-fluoro,4 1h-pyridinone, 2-fluoro-9ci |
| IUPAC Name | 2-fluoro-1H-pyridin-4-one |
| InChI Key | BRLSDLHMGRDAPF-UHFFFAOYSA-N |
| Molecular Formula | C5H4FNO |
1-(4-Trifluoromethyl-2-pyrimidinyl)-1H-pyrazole-4-sulfonyl chloride, 95%
CAS: 1215564-15-0 Molecular Formula: C8H4ClF3N4O2S Molecular Weight (g/mol): 312.651 MDL Number: MFCD11505058 InChI Key: SADUDBJMXGGXDE-UHFFFAOYSA-N Synonym: 1-4-trifluoromethyl-2-pyrimidinyl-1h-pyrazole-4-sulfonyl chloride,1-4-trifluoromethyl pyrimidin-2-yl-1h-pyrazole-4-sulfonyl chloride,1-4-trifluoromethyl pyrimidin-2-yl-1h-pyrazole-4-sulphonyl chloride,1-4-trifluoromethyl pyrimidin-2-yl pyrazole-4-sulfonyl chloride,chloro 1-4-trifluoromethyl pyrimidin-2-yl pyrazol-4-yl sulfone PubChem CID: 51063957 IUPAC Name: 1-[4-(trifluoromethyl)pyrimidin-2-yl]pyrazole-4-sulfonyl chloride SMILES: C1=CN=C(N=C1C(F)(F)F)N2C=C(C=N2)S(=O)(=O)Cl
| PubChem CID | 51063957 |
|---|---|
| CAS | 1215564-15-0 |
| Molecular Weight (g/mol) | 312.651 |
| MDL Number | MFCD11505058 |
| SMILES | C1=CN=C(N=C1C(F)(F)F)N2C=C(C=N2)S(=O)(=O)Cl |
| Synonym | 1-4-trifluoromethyl-2-pyrimidinyl-1h-pyrazole-4-sulfonyl chloride,1-4-trifluoromethyl pyrimidin-2-yl-1h-pyrazole-4-sulfonyl chloride,1-4-trifluoromethyl pyrimidin-2-yl-1h-pyrazole-4-sulphonyl chloride,1-4-trifluoromethyl pyrimidin-2-yl pyrazole-4-sulfonyl chloride,chloro 1-4-trifluoromethyl pyrimidin-2-yl pyrazol-4-yl sulfone |
| IUPAC Name | 1-[4-(trifluoromethyl)pyrimidin-2-yl]pyrazole-4-sulfonyl chloride |
| InChI Key | SADUDBJMXGGXDE-UHFFFAOYSA-N |
| Molecular Formula | C8H4ClF3N4O2S |
3-Bromo-6-cyanoimidazo[1,2-a]pyridine, 95%
CAS: 885950-21-0 Molecular Formula: C8H4BrN3 Molecular Weight (g/mol): 222.05 MDL Number: MFCD06659617 InChI Key: UOQHWNPVNXSDDO-UHFFFAOYSA-N Synonym: 3-bromoimidazo 1,2-a pyridine-6-carbonitrile,3-bromo-6-cyanoimidazo 1,2-a pyridine,3-bromo-4-hydroimidazo 1,2-a pyridine-6-carbonitrile PubChem CID: 2764571 IUPAC Name: 3-bromoimidazo[1,2-a]pyridine-6-carbonitrile SMILES: BrC1=CN=C2C=CC(=CN12)C#N
| PubChem CID | 2764571 |
|---|---|
| CAS | 885950-21-0 |
| Molecular Weight (g/mol) | 222.05 |
| MDL Number | MFCD06659617 |
| SMILES | BrC1=CN=C2C=CC(=CN12)C#N |
| Synonym | 3-bromoimidazo 1,2-a pyridine-6-carbonitrile,3-bromo-6-cyanoimidazo 1,2-a pyridine,3-bromo-4-hydroimidazo 1,2-a pyridine-6-carbonitrile |
| IUPAC Name | 3-bromoimidazo[1,2-a]pyridine-6-carbonitrile |
| InChI Key | UOQHWNPVNXSDDO-UHFFFAOYSA-N |
| Molecular Formula | C8H4BrN3 |
trans-2,3-Epoxybutane, 97%
CAS: 21490-63-1 Molecular Formula: C4H8O Molecular Weight (g/mol): 72.107 MDL Number: MFCD00005129 InChI Key: PQXKWPLDPFFDJP-QWWZWVQMSA-N Synonym: trans-2,3-dimethyloxirane,trans-2,3-epoxybutane,2r,3r-2,3-dimethyloxirane,oxirane, 2,3-dimethyl-, trans,trans-2-butene oxide,butane, 2,3-epoxy-, trans,e-2r,3r-epoxybutane,trans-,a-butylene oxide,trans-2r,3r-epoxybutane,2,3-dimethyloxirane, trans PubChem CID: 6432237 IUPAC Name: (2R,3R)-2,3-dimethyloxirane SMILES: CC1C(O1)C
| PubChem CID | 6432237 |
|---|---|
| CAS | 21490-63-1 |
| Molecular Weight (g/mol) | 72.107 |
| MDL Number | MFCD00005129 |
| SMILES | CC1C(O1)C |
| Synonym | trans-2,3-dimethyloxirane,trans-2,3-epoxybutane,2r,3r-2,3-dimethyloxirane,oxirane, 2,3-dimethyl-, trans,trans-2-butene oxide,butane, 2,3-epoxy-, trans,e-2r,3r-epoxybutane,trans-,a-butylene oxide,trans-2r,3r-epoxybutane,2,3-dimethyloxirane, trans |
| IUPAC Name | (2R,3R)-2,3-dimethyloxirane |
| InChI Key | PQXKWPLDPFFDJP-QWWZWVQMSA-N |
| Molecular Formula | C4H8O |
5-Formyl-4-methylthiophene-2-boronic acid, 97%
CAS: 352530-25-7 Molecular Formula: C6H7BO3S Molecular Weight (g/mol): 169.99 MDL Number: MFCD03093890 InChI Key: QEIXJCOHLUKRPO-UHFFFAOYSA-N Synonym: 5-formyl-4-methylthiophen-2-yl boronic acid,5-borono-3-methylthiophene-2-carboxaldehyde,5-formyl-4-methylthiophene-2-boronic acid,zlchem 1324,acmc-209iey,5-borono-3-methylthiophene-2-carbaldehyde,b-5-formyl-4-methyl-2-thienyl boronic acid,boronicacid,b-5-formyl-4-methyl-2-thienyl PubChem CID: 46738927 IUPAC Name: (5-formyl-4-methylthiophen-2-yl)boronic acid SMILES: CC1=C(SC(=C1)B(O)O)C=O
| PubChem CID | 46738927 |
|---|---|
| CAS | 352530-25-7 |
| Molecular Weight (g/mol) | 169.99 |
| MDL Number | MFCD03093890 |
| SMILES | CC1=C(SC(=C1)B(O)O)C=O |
| Synonym | 5-formyl-4-methylthiophen-2-yl boronic acid,5-borono-3-methylthiophene-2-carboxaldehyde,5-formyl-4-methylthiophene-2-boronic acid,zlchem 1324,acmc-209iey,5-borono-3-methylthiophene-2-carbaldehyde,b-5-formyl-4-methyl-2-thienyl boronic acid,boronicacid,b-5-formyl-4-methyl-2-thienyl |
| IUPAC Name | (5-formyl-4-methylthiophen-2-yl)boronic acid |
| InChI Key | QEIXJCOHLUKRPO-UHFFFAOYSA-N |
| Molecular Formula | C6H7BO3S |
2-Methyl-3-furoic acid, 98%
CAS: 6947-94-0 Molecular Formula: C6H6O3 Molecular Weight (g/mol): 126.111 MDL Number: MFCD00092314 InChI Key: CFGQZVOVFIZRMN-UHFFFAOYSA-N PubChem CID: 244756 IUPAC Name: 2-methylfuran-3-carboxylic acid SMILES: CC1=C(C=CO1)C(=O)O
| PubChem CID | 244756 |
|---|---|
| CAS | 6947-94-0 |
| Molecular Weight (g/mol) | 126.111 |
| MDL Number | MFCD00092314 |
| SMILES | CC1=C(C=CO1)C(=O)O |
| IUPAC Name | 2-methylfuran-3-carboxylic acid |
| InChI Key | CFGQZVOVFIZRMN-UHFFFAOYSA-N |
| Molecular Formula | C6H6O3 |
2-Bromo-4-(trifluoromethyl)pyridine, 97%
CAS: 175205-81-9 Molecular Formula: C6H3BrF3N Molecular Weight (g/mol): 225.996 MDL Number: MFCD00153085 InChI Key: WZVHLUMAQLUNTJ-UHFFFAOYSA-N Synonym: 2-bromo-4-trifluoromethyl pyridine,pyridine, 2-bromo-4-trifluoromethyl,2-bromo-4-trifluoromethyl-pyridine,2-bromo-4-trifluormethyl pyridine,pubchem8064,acmc-209e9d,abbypharma ap-11-5529 PubChem CID: 2781543 IUPAC Name: 2-bromo-4-(trifluoromethyl)pyridine SMILES: C1=CN=C(C=C1C(F)(F)F)Br
| PubChem CID | 2781543 |
|---|---|
| CAS | 175205-81-9 |
| Molecular Weight (g/mol) | 225.996 |
| MDL Number | MFCD00153085 |
| SMILES | C1=CN=C(C=C1C(F)(F)F)Br |
| Synonym | 2-bromo-4-trifluoromethyl pyridine,pyridine, 2-bromo-4-trifluoromethyl,2-bromo-4-trifluoromethyl-pyridine,2-bromo-4-trifluormethyl pyridine,pubchem8064,acmc-209e9d,abbypharma ap-11-5529 |
| IUPAC Name | 2-bromo-4-(trifluoromethyl)pyridine |
| InChI Key | WZVHLUMAQLUNTJ-UHFFFAOYSA-N |
| Molecular Formula | C6H3BrF3N |
2-(4-Bromophenoxy)tetrahydropyran, 98%
CAS: 36603-49-3 Molecular Formula: C11H13BrO2 Molecular Weight (g/mol): 257.127 MDL Number: MFCD00091551 InChI Key: MXDQGXMBJCGRCB-UHFFFAOYSA-N Synonym: 2-4-bromophenoxy tetrahydro-2h-pyran,2-4-bromophenoxy tetrahydropyran,2-4-bromophenoxy oxane,2h-pyran, 2-4-bromophenoxy tetrahydro,2-4'-bromophenoxy-tetrahydropyran,4-bromophenyl thp ether,acmc-209inn,bromophenoxy tetrahydro-2h-pyran,2-4-bromophenoxy-tetrahydropyran PubChem CID: 4646436 IUPAC Name: 2-(4-bromophenoxy)oxane SMILES: C1CCOC(C1)OC2=CC=C(C=C2)Br
| PubChem CID | 4646436 |
|---|---|
| CAS | 36603-49-3 |
| Molecular Weight (g/mol) | 257.127 |
| MDL Number | MFCD00091551 |
| SMILES | C1CCOC(C1)OC2=CC=C(C=C2)Br |
| Synonym | 2-4-bromophenoxy tetrahydro-2h-pyran,2-4-bromophenoxy tetrahydropyran,2-4-bromophenoxy oxane,2h-pyran, 2-4-bromophenoxy tetrahydro,2-4'-bromophenoxy-tetrahydropyran,4-bromophenyl thp ether,acmc-209inn,bromophenoxy tetrahydro-2h-pyran,2-4-bromophenoxy-tetrahydropyran |
| IUPAC Name | 2-(4-bromophenoxy)oxane |
| InChI Key | MXDQGXMBJCGRCB-UHFFFAOYSA-N |
| Molecular Formula | C11H13BrO2 |
Ethyl picolinate, 99%
CAS: 2524-52-9 Molecular Formula: C8H9NO2 Molecular Weight (g/mol): 151.17 MDL Number: MFCD00006292 InChI Key: FQYYIPZPELSLDK-UHFFFAOYSA-N Synonym: ethyl picolinate,ethyl 2-picolinate,ethyl 2-pyridinecarboxylate,picolinic acid, ethyl ester,2-picolinic acid ethyl ester,2-pyridinecarboxylic acid, ethyl ester,2-ethoxycarbonyl pyridine,picolinic acid ethyl ester,2-pyridinecarboxylic acid ethyl ester,pyridine-2-carboxylic acid ethyl ester PubChem CID: 17307 IUPAC Name: ethyl pyridine-2-carboxylate SMILES: CCOC(=O)C1=CC=CC=N1
| PubChem CID | 17307 |
|---|---|
| CAS | 2524-52-9 |
| Molecular Weight (g/mol) | 151.17 |
| MDL Number | MFCD00006292 |
| SMILES | CCOC(=O)C1=CC=CC=N1 |
| Synonym | ethyl picolinate,ethyl 2-picolinate,ethyl 2-pyridinecarboxylate,picolinic acid, ethyl ester,2-picolinic acid ethyl ester,2-pyridinecarboxylic acid, ethyl ester,2-ethoxycarbonyl pyridine,picolinic acid ethyl ester,2-pyridinecarboxylic acid ethyl ester,pyridine-2-carboxylic acid ethyl ester |
| IUPAC Name | ethyl pyridine-2-carboxylate |
| InChI Key | FQYYIPZPELSLDK-UHFFFAOYSA-N |
| Molecular Formula | C8H9NO2 |
5-Amino-1-methyl-3-phenyl-1H-pyrazole, 97%
CAS: 10199-50-5 Molecular Formula: C10H11N3 Molecular Weight (g/mol): 173.219 MDL Number: MFCD00067874 InChI Key: KCYRMURRLLYLPU-UHFFFAOYSA-N Synonym: 1-methyl-3-phenyl-1h-pyrazol-5-amine,5-amino-1-methyl-3-phenylpyrazole,5-amino-1-methyl-3-phenyl-1h-pyrazole,2-methyl-5-phenyl-2h-pyrazol-3-ylamine,1-methyl-3-phenylpyrazole-5-ylamine,acmc-1bxci,maybridge1_004465,1-methyl-3-phenyl-5-pyrazolamine,1-methyl-3-phenyl-pyrazol-5-amine,2-methyl-5-phenyl-pyrazol-3-amine PubChem CID: 517779 IUPAC Name: 2-methyl-5-phenylpyrazol-3-amine SMILES: CN1C(=CC(=N1)C2=CC=CC=C2)N
| PubChem CID | 517779 |
|---|---|
| CAS | 10199-50-5 |
| Molecular Weight (g/mol) | 173.219 |
| MDL Number | MFCD00067874 |
| SMILES | CN1C(=CC(=N1)C2=CC=CC=C2)N |
| Synonym | 1-methyl-3-phenyl-1h-pyrazol-5-amine,5-amino-1-methyl-3-phenylpyrazole,5-amino-1-methyl-3-phenyl-1h-pyrazole,2-methyl-5-phenyl-2h-pyrazol-3-ylamine,1-methyl-3-phenylpyrazole-5-ylamine,acmc-1bxci,maybridge1_004465,1-methyl-3-phenyl-5-pyrazolamine,1-methyl-3-phenyl-pyrazol-5-amine,2-methyl-5-phenyl-pyrazol-3-amine |
| IUPAC Name | 2-methyl-5-phenylpyrazol-3-amine |
| InChI Key | KCYRMURRLLYLPU-UHFFFAOYSA-N |
| Molecular Formula | C10H11N3 |
(R)-(+)-Indoline-2-carboxylic acid, 97%, Thermo Scientific Chemicals
CAS: 98167-06-7 Molecular Formula: C9H9NO2 Molecular Weight (g/mol): 163.176 MDL Number: MFCD00792496 InChI Key: QNRXNRGSOJZINA-MRVPVSSYSA-N Synonym: r-indoline-2-carboxylic acid,r-+-indoline-2-carboxylic acid,2r-2,3-dihydro-1h-indole-2-carboxylic acid,r---indoline-2-carboxylic acid,2r-indoline-2-carboxylic acid,r-+-2,3-dihydroindole-2-carboxylic acid,r-2,3-dihydro-1h-indole-2-carboxylic acid,1h-indole-2-carboxylic acid, 2,3-dihydro-, 2r,pubchem20604 PubChem CID: 6928266 IUPAC Name: (2R)-2,3-dihydro-1H-indole-2-carboxylic acid SMILES: C1C(NC2=CC=CC=C21)C(=O)O
| PubChem CID | 6928266 |
|---|---|
| CAS | 98167-06-7 |
| Molecular Weight (g/mol) | 163.176 |
| MDL Number | MFCD00792496 |
| SMILES | C1C(NC2=CC=CC=C21)C(=O)O |
| Synonym | r-indoline-2-carboxylic acid,r-+-indoline-2-carboxylic acid,2r-2,3-dihydro-1h-indole-2-carboxylic acid,r---indoline-2-carboxylic acid,2r-indoline-2-carboxylic acid,r-+-2,3-dihydroindole-2-carboxylic acid,r-2,3-dihydro-1h-indole-2-carboxylic acid,1h-indole-2-carboxylic acid, 2,3-dihydro-, 2r,pubchem20604 |
| IUPAC Name | (2R)-2,3-dihydro-1H-indole-2-carboxylic acid |
| InChI Key | QNRXNRGSOJZINA-MRVPVSSYSA-N |
| Molecular Formula | C9H9NO2 |
2-Hydroxycarbazole, 97%
CAS: 86-79-3 Molecular Formula: C12H9NO Molecular Weight (g/mol): 183.21 MDL Number: MFCD00004962 InChI Key: GWPGDZPXOZATKL-UHFFFAOYSA-N Synonym: 2-hydroxycarbazole,carbazol-2-ol,ccris 5301,2-hydroxycarbazol,7-hydroxycarbazole,2-hydroxy carbazole,pubchem9945,pubchem9949,2-hydroxy-9h-carbazol,2-hydroxy-9h-carbazole PubChem CID: 93551 IUPAC Name: 9H-carbazol-2-ol SMILES: OC1=CC2=C(C=C1)C1=C(N2)C=CC=C1
| PubChem CID | 93551 |
|---|---|
| CAS | 86-79-3 |
| Molecular Weight (g/mol) | 183.21 |
| MDL Number | MFCD00004962 |
| SMILES | OC1=CC2=C(C=C1)C1=C(N2)C=CC=C1 |
| Synonym | 2-hydroxycarbazole,carbazol-2-ol,ccris 5301,2-hydroxycarbazol,7-hydroxycarbazole,2-hydroxy carbazole,pubchem9945,pubchem9949,2-hydroxy-9h-carbazol,2-hydroxy-9h-carbazole |
| IUPAC Name | 9H-carbazol-2-ol |
| InChI Key | GWPGDZPXOZATKL-UHFFFAOYSA-N |
| Molecular Formula | C12H9NO |