Organoheterocyclic compounds
Filtered Search Results
Phthalide, 99%
CAS: 87-41-2 MDL Number: MFCD00005906 InChI Key: WNZQDUSMALZDQF-UHFFFAOYSA-N Synonym: phthalide,isobenzofuran-1 3h-one,1 3h-isobenzofuranone,1-phthalanone,phthalolactone,2-benzofuran-1 3h-one,isobenzofuranone,phthalanone,3h-isobenzofuran-1-one,2-hydroxymethylbenzoic acid, gamma-lactone PubChem CID: 6885 ChEBI: CHEBI:38085 IUPAC Name: 3H-2-benzofuran-1-one SMILES: C1C2=CC=CC=C2C(=O)O1
| PubChem CID | 6885 |
|---|---|
| CAS | 87-41-2 |
| ChEBI | CHEBI:38085 |
| MDL Number | MFCD00005906 |
| SMILES | C1C2=CC=CC=C2C(=O)O1 |
| Synonym | phthalide,isobenzofuran-1 3h-one,1 3h-isobenzofuranone,1-phthalanone,phthalolactone,2-benzofuran-1 3h-one,isobenzofuranone,phthalanone,3h-isobenzofuran-1-one,2-hydroxymethylbenzoic acid, gamma-lactone |
| IUPAC Name | 3H-2-benzofuran-1-one |
| InChI Key | WNZQDUSMALZDQF-UHFFFAOYSA-N |
N-Methylcarbazole, 99%, Thermo Scientific Chemicals
CAS: 1484-12-4 Molecular Formula: C13H11N Molecular Weight (g/mol): 181.24 InChI Key: SDFLTYHTFPTIGX-UHFFFAOYSA-N Synonym: n-methylcarbazole,9-methyl-9h-carbazole,9h-carbazole, 9-methyl,carbazole, 9-methyl,n-methyldibenzopyrrole,unii-76sop090pg,ccris 6846,n-methyl carbazole,pubchem17421,9-methylcarbazole PubChem CID: 15142 IUPAC Name: 9-methylcarbazole SMILES: CN1C2=CC=CC=C2C3=CC=CC=C31
| PubChem CID | 15142 |
|---|---|
| CAS | 1484-12-4 |
| Molecular Weight (g/mol) | 181.24 |
| SMILES | CN1C2=CC=CC=C2C3=CC=CC=C31 |
| Synonym | n-methylcarbazole,9-methyl-9h-carbazole,9h-carbazole, 9-methyl,carbazole, 9-methyl,n-methyldibenzopyrrole,unii-76sop090pg,ccris 6846,n-methyl carbazole,pubchem17421,9-methylcarbazole |
| IUPAC Name | 9-methylcarbazole |
| InChI Key | SDFLTYHTFPTIGX-UHFFFAOYSA-N |
| Molecular Formula | C13H11N |
N-Iodosuccinimide, 97%
CAS: 516-12-1 Molecular Formula: C4H4INO2 Molecular Weight (g/mol): 224.99 MDL Number: MFCD00005512 InChI Key: LQZMLBORDGWNPD-UHFFFAOYSA-N Synonym: n-iodosuccinimide,succiniodimide,n-iodo succinimide,2,5-pyrrolidinedione, 1-iodo,unii-3cos3x3n4p,nis,succinimide, n-iodo,3cos3x3n4p,1-iodo-pyrrolidine-2,5-dione,1-iodoazolidine-2,5-dione PubChem CID: 120273 ChEBI: CHEBI:53204 IUPAC Name: 1-iodopyrrolidine-2,5-dione SMILES: IN1C(=O)CCC1=O
| PubChem CID | 120273 |
|---|---|
| CAS | 516-12-1 |
| Molecular Weight (g/mol) | 224.99 |
| ChEBI | CHEBI:53204 |
| MDL Number | MFCD00005512 |
| SMILES | IN1C(=O)CCC1=O |
| Synonym | n-iodosuccinimide,succiniodimide,n-iodo succinimide,2,5-pyrrolidinedione, 1-iodo,unii-3cos3x3n4p,nis,succinimide, n-iodo,3cos3x3n4p,1-iodo-pyrrolidine-2,5-dione,1-iodoazolidine-2,5-dione |
| IUPAC Name | 1-iodopyrrolidine-2,5-dione |
| InChI Key | LQZMLBORDGWNPD-UHFFFAOYSA-N |
| Molecular Formula | C4H4INO2 |
Praziquantel, 98%
CAS: 55268-74-1 Molecular Formula: C19H24N2O2 Molecular Weight (g/mol): 312.413 MDL Number: MFCD00058531 InChI Key: FSVJFNAIGNNGKK-UHFFFAOYSA-N Synonym: praziquantel,droncit,biltricide,pyquiton,cesol,azinox,embay 8440,cutter tape tabs,prasiquantel,praziquantelum PubChem CID: 4891 IUPAC Name: 2-(cyclohexanecarbonyl)-3,6,7,11b-tetrahydro-1H-pyrazino[2,1-a]isoquinolin-4-one SMILES: C1CCC(CC1)C(=O)N2CC3C4=CC=CC=C4CCN3C(=O)C2
| PubChem CID | 4891 |
|---|---|
| CAS | 55268-74-1 |
| Molecular Weight (g/mol) | 312.413 |
| MDL Number | MFCD00058531 |
| SMILES | C1CCC(CC1)C(=O)N2CC3C4=CC=CC=C4CCN3C(=O)C2 |
| Synonym | praziquantel,droncit,biltricide,pyquiton,cesol,azinox,embay 8440,cutter tape tabs,prasiquantel,praziquantelum |
| IUPAC Name | 2-(cyclohexanecarbonyl)-3,6,7,11b-tetrahydro-1H-pyrazino[2,1-a]isoquinolin-4-one |
| InChI Key | FSVJFNAIGNNGKK-UHFFFAOYSA-N |
| Molecular Formula | C19H24N2O2 |
Thermo Scientific Chemicals Atorvastatin calcium trihydrate
CAS: 344423-98-9 Molecular Formula: C66H74CaF2N4O13 Molecular Weight (g/mol): 1209.41 InChI Key: SHZPNDRIDUBNMH-NIJVSVLQSA-L IUPAC Name: calcium bis((3R,5R)-7-[2-(4-fluorophenyl)-3-phenyl-4-(phenylcarbamoyl)-5-(propan-2-yl)-1H-pyrrol-1-yl]-3,5-dihydroxyheptanoate) trihydrate SMILES: O.O.O.[Ca++].CC(C)C1=C(C(=O)NC2=CC=CC=C2)C(=C(N1CC[C@@H](O)C[C@@H](O)CC([O-])=O)C1=CC=C(F)C=C1)C1=CC=CC=C1.CC(C)C1=C(C(=O)NC2=CC=CC=C2)C(=C(N1CC[C@@H](O)C[C@@H](O)CC([O-])=O)C1=CC=C(F)C=C1)C1=CC=CC=C1
| CAS | 344423-98-9 |
|---|---|
| Molecular Weight (g/mol) | 1209.41 |
| SMILES | O.O.O.[Ca++].CC(C)C1=C(C(=O)NC2=CC=CC=C2)C(=C(N1CC[C@@H](O)C[C@@H](O)CC([O-])=O)C1=CC=C(F)C=C1)C1=CC=CC=C1.CC(C)C1=C(C(=O)NC2=CC=CC=C2)C(=C(N1CC[C@@H](O)C[C@@H](O)CC([O-])=O)C1=CC=C(F)C=C1)C1=CC=CC=C1 |
| IUPAC Name | calcium bis((3R,5R)-7-[2-(4-fluorophenyl)-3-phenyl-4-(phenylcarbamoyl)-5-(propan-2-yl)-1H-pyrrol-1-yl]-3,5-dihydroxyheptanoate) trihydrate |
| InChI Key | SHZPNDRIDUBNMH-NIJVSVLQSA-L |
| Molecular Formula | C66H74CaF2N4O13 |
Pyrazine-2-carbonitrile, 97+%
CAS: 19847-12-2 Molecular Formula: C5H3N3 Molecular Weight (g/mol): 105.10 MDL Number: MFCD00049361 InChI Key: PMSVVUSIPKHUMT-UHFFFAOYSA-N Synonym: pyrazinecarbonitrile,2-cyanopyrazine,cyanopyrazine,2-pyrazinecarbonitrile,pyrazinenitrile,pyrazinonitrile,2-cyanopyarine,2-cyano pyrazine PubChem CID: 73172 ChEBI: CHEBI:3982 IUPAC Name: pyrazine-2-carbonitrile SMILES: N#CC1=CN=CC=N1
| PubChem CID | 73172 |
|---|---|
| CAS | 19847-12-2 |
| Molecular Weight (g/mol) | 105.10 |
| ChEBI | CHEBI:3982 |
| MDL Number | MFCD00049361 |
| SMILES | N#CC1=CN=CC=N1 |
| Synonym | pyrazinecarbonitrile,2-cyanopyrazine,cyanopyrazine,2-pyrazinecarbonitrile,pyrazinenitrile,pyrazinonitrile,2-cyanopyarine,2-cyano pyrazine |
| IUPAC Name | pyrazine-2-carbonitrile |
| InChI Key | PMSVVUSIPKHUMT-UHFFFAOYSA-N |
| Molecular Formula | C5H3N3 |
2,3-Diphenylpyrazine, 98%
CAS: 1588-89-2 Molecular Formula: C16H12N2 Molecular Weight (g/mol): 232.286 MDL Number: MFCD00053000 InChI Key: PTZIVVDMBCVSMR-UHFFFAOYSA-N Synonym: 2,3-diphenyl-pyrazine,chembl48222,bis-phenyl pyrazine,maybridge1_007492,acmc-1bu2l PubChem CID: 243907 IUPAC Name: 2,3-diphenylpyrazine SMILES: C1=CC=C(C=C1)C2=NC=CN=C2C3=CC=CC=C3
| PubChem CID | 243907 |
|---|---|
| CAS | 1588-89-2 |
| Molecular Weight (g/mol) | 232.286 |
| MDL Number | MFCD00053000 |
| SMILES | C1=CC=C(C=C1)C2=NC=CN=C2C3=CC=CC=C3 |
| Synonym | 2,3-diphenyl-pyrazine,chembl48222,bis-phenyl pyrazine,maybridge1_007492,acmc-1bu2l |
| IUPAC Name | 2,3-diphenylpyrazine |
| InChI Key | PTZIVVDMBCVSMR-UHFFFAOYSA-N |
| Molecular Formula | C16H12N2 |
(+/-)-Styrene oxide, 98+%
CAS: 96-09-3 Molecular Formula: C8H8O Molecular Weight (g/mol): 120.151 MDL Number: MFCD00005121 InChI Key: AWMVMTVKBNGEAK-UHFFFAOYSA-N Synonym: styrene oxide,phenyloxirane,1,2-epoxyethylbenzene,phenylethylene oxide,epoxystyrene,styrene epoxide,styryl oxide,oxirane, phenyl,1-phenyloxirane,phenethylene oxide PubChem CID: 7276 ChEBI: CHEBI:17907 IUPAC Name: 2-phenyloxirane SMILES: C1C(O1)C2=CC=CC=C2
| PubChem CID | 7276 |
|---|---|
| CAS | 96-09-3 |
| Molecular Weight (g/mol) | 120.151 |
| ChEBI | CHEBI:17907 |
| MDL Number | MFCD00005121 |
| SMILES | C1C(O1)C2=CC=CC=C2 |
| Synonym | styrene oxide,phenyloxirane,1,2-epoxyethylbenzene,phenylethylene oxide,epoxystyrene,styrene epoxide,styryl oxide,oxirane, phenyl,1-phenyloxirane,phenethylene oxide |
| IUPAC Name | 2-phenyloxirane |
| InChI Key | AWMVMTVKBNGEAK-UHFFFAOYSA-N |
| Molecular Formula | C8H8O |
Vitamin B12 95.0+%, TCI America™
CAS: 68-19-9 Molecular Formula: C63H88CoN14O14P Molecular Weight (g/mol): 1355.39 MDL Number: MFCD00151092 InChI Key: YUWVGNQGDAPKCX-BVWPOUIRNA-L Synonym: vitamin b12 PubChem CID: 129893524 IUPAC Name: (10S,12R,13R,24S,35R,41R)-30,35,40-tris(2-carbamoylethyl)-24,36,41-tris(carbamoylmethyl)-1-cyano-46-hydroxy-12-(hydroxymethyl)-5,6,17,23,28,31,31,36,38,41,42-undecamethyl-15,20-dioxo-11,14,16-trioxa-2λ⁵,9,19,26λ⁵,43,44λ⁵,45λ⁵-heptaaza-15λ⁵-phospha-1-cobaltadodecacyclo[27.14.1.1¹,³⁴.1²,⁹.1¹⁰,¹³.0¹,²⁶.0³,⁸.0²³,²⁷.0²⁵,⁴².0³²,⁴⁴.0³⁹,⁴³.0³⁷,⁴⁵]heptatetraconta-2(47),3,5,7,26,28,32(44),33,37(45),38-decaene-1,2,26,44,45-pentakis(ylium)-15-olate SMILES: [C@@H]1(C2=CC3=[N+]4C(C(C3(C)C)CCC(N)=O)=C(C3=[N+]5C6C7(N8C(C([C@@]7(C)CC(N)=O)CCC(N)=O)=C(C(=[N+]2[Co+]458([N+]2=CN(C4=CC(=C(C)C=C24)C)[C@@]2([H])O[C@@H]([C@]([H])(OP([O-])(=O)OC(C)CNC(=O)CCC3(C)[C@@H]6CC(N)=O)C2O)CO)C#N)C1(C)CC(N)=O)C)C)C)CCC(N)=O
| PubChem CID | 129893524 |
|---|---|
| CAS | 68-19-9 |
| Molecular Weight (g/mol) | 1355.39 |
| MDL Number | MFCD00151092 |
| SMILES | [C@@H]1(C2=CC3=[N+]4C(C(C3(C)C)CCC(N)=O)=C(C3=[N+]5C6C7(N8C(C([C@@]7(C)CC(N)=O)CCC(N)=O)=C(C(=[N+]2[Co+]458([N+]2=CN(C4=CC(=C(C)C=C24)C)[C@@]2([H])O[C@@H]([C@]([H])(OP([O-])(=O)OC(C)CNC(=O)CCC3(C)[C@@H]6CC(N)=O)C2O)CO)C#N)C1(C)CC(N)=O)C)C)C)CCC(N)=O |
| Synonym | vitamin b12 |
| IUPAC Name | (10S,12R,13R,24S,35R,41R)-30,35,40-tris(2-carbamoylethyl)-24,36,41-tris(carbamoylmethyl)-1-cyano-46-hydroxy-12-(hydroxymethyl)-5,6,17,23,28,31,31,36,38,41,42-undecamethyl-15,20-dioxo-11,14,16-trioxa-2λ⁵,9,19,26λ⁵,43,44λ⁵,45λ⁵-heptaaza-15λ⁵-phospha-1-cobaltadodecacyclo[27.14.1.1¹,³⁴.1²,⁹.1¹⁰,¹³.0¹,²⁶.0³,⁸.0²³,²⁷.0²⁵,⁴².0³²,⁴⁴.0³⁹,⁴³.0³⁷,⁴⁵]heptatetraconta-2(47),3,5,7,26,28,32(44),33,37(45),38-decaene-1,2,26,44,45-pentakis(ylium)-15-olate |
| InChI Key | YUWVGNQGDAPKCX-BVWPOUIRNA-L |
| Molecular Formula | C63H88CoN14O14P |
Styrene oxide, 97+%
CAS: 96-09-3 Molecular Formula: C8H8O Molecular Weight (g/mol): 120.15 MDL Number: MFCD00005121 InChI Key: AWMVMTVKBNGEAK-UHFFFAOYSA-N Synonym: styrene oxide,phenyloxirane,1,2-epoxyethylbenzene,phenylethylene oxide,epoxystyrene,styrene epoxide,styryl oxide,oxirane, phenyl,1-phenyloxirane,phenethylene oxide PubChem CID: 7276 ChEBI: CHEBI:17907 IUPAC Name: 2-phenyloxirane SMILES: C1C(O1)C2=CC=CC=C2
| PubChem CID | 7276 |
|---|---|
| CAS | 96-09-3 |
| Molecular Weight (g/mol) | 120.15 |
| ChEBI | CHEBI:17907 |
| MDL Number | MFCD00005121 |
| SMILES | C1C(O1)C2=CC=CC=C2 |
| Synonym | styrene oxide,phenyloxirane,1,2-epoxyethylbenzene,phenylethylene oxide,epoxystyrene,styrene epoxide,styryl oxide,oxirane, phenyl,1-phenyloxirane,phenethylene oxide |
| IUPAC Name | 2-phenyloxirane |
| InChI Key | AWMVMTVKBNGEAK-UHFFFAOYSA-N |
| Molecular Formula | C8H8O |
Acridine, 97%
CAS: 260-94-6 Molecular Formula: C13H9N Molecular Weight (g/mol): 179.222 MDL Number: MFCD00005025 InChI Key: DZBUGLKDJFMEHC-UHFFFAOYSA-N Synonym: 9-azaanthracene,2,3-benzoquinoline,acrydine,10-azaanthracene,akridin,dibenzo b,e pyridine,2,3,5,6-dibenzopyridine,akridin czech,benzo b quinoline PubChem CID: 9215 ChEBI: CHEBI:36420 IUPAC Name: acridine SMILES: C1=CC=C2C(=C1)C=C3C=CC=CC3=N2
| PubChem CID | 9215 |
|---|---|
| CAS | 260-94-6 |
| Molecular Weight (g/mol) | 179.222 |
| ChEBI | CHEBI:36420 |
| MDL Number | MFCD00005025 |
| SMILES | C1=CC=C2C(=C1)C=C3C=CC=CC3=N2 |
| Synonym | 9-azaanthracene,2,3-benzoquinoline,acrydine,10-azaanthracene,akridin,dibenzo b,e pyridine,2,3,5,6-dibenzopyridine,akridin czech,benzo b quinoline |
| IUPAC Name | acridine |
| InChI Key | DZBUGLKDJFMEHC-UHFFFAOYSA-N |
| Molecular Formula | C13H9N |
4-Vinylpyridine, 95%, stab. with 80 to 150ppm hydroquinone
CAS: 100-43-6 Molecular Formula: C7H7N Molecular Weight (g/mol): 105.14 MDL Number: MFCD00006447 InChI Key: KFDVPJUYSDEJTH-UHFFFAOYSA-N Synonym: 4-vinylpyridine,pyridine, 4-ethenyl,pyridine, 4-vinyl,gamma-vinylpyridine,unii-i56g67xm8d,ccris 5240,4vp,4-pyridylethylene,4-vinyl-pyridine,4-vinyl pyridine PubChem CID: 7502 IUPAC Name: 4-ethenylpyridine SMILES: C=CC1=CC=NC=C1
| PubChem CID | 7502 |
|---|---|
| CAS | 100-43-6 |
| Molecular Weight (g/mol) | 105.14 |
| MDL Number | MFCD00006447 |
| SMILES | C=CC1=CC=NC=C1 |
| Synonym | 4-vinylpyridine,pyridine, 4-ethenyl,pyridine, 4-vinyl,gamma-vinylpyridine,unii-i56g67xm8d,ccris 5240,4vp,4-pyridylethylene,4-vinyl-pyridine,4-vinyl pyridine |
| IUPAC Name | 4-ethenylpyridine |
| InChI Key | KFDVPJUYSDEJTH-UHFFFAOYSA-N |
| Molecular Formula | C7H7N |
5,6-Dihydroxyindole, 95%
CAS: 3131-52-0 Molecular Formula: C8H7NO2 Molecular Weight (g/mol): 149.149 MDL Number: MFCD00798933 InChI Key: SGNZYJXNUURYCH-UHFFFAOYSA-N Synonym: 5,6-dihydroxyindole,dopamine lutine,3h-indole-5,6-diol,5,6-dihydroxy-1h-indole,dhi,unii-z3oc8499kg,5,6-dihydroxyindolei,chembl92636,3id,5,6-dihydroxy indole PubChem CID: 114683 ChEBI: CHEBI:27404 IUPAC Name: 1H-indole-5,6-diol SMILES: C1=CNC2=CC(=C(C=C21)O)O
| PubChem CID | 114683 |
|---|---|
| CAS | 3131-52-0 |
| Molecular Weight (g/mol) | 149.149 |
| ChEBI | CHEBI:27404 |
| MDL Number | MFCD00798933 |
| SMILES | C1=CNC2=CC(=C(C=C21)O)O |
| Synonym | 5,6-dihydroxyindole,dopamine lutine,3h-indole-5,6-diol,5,6-dihydroxy-1h-indole,dhi,unii-z3oc8499kg,5,6-dihydroxyindolei,chembl92636,3id,5,6-dihydroxy indole |
| IUPAC Name | 1H-indole-5,6-diol |
| InChI Key | SGNZYJXNUURYCH-UHFFFAOYSA-N |
| Molecular Formula | C8H7NO2 |
Xanthene 98.0+%, TCI America™
CAS: 92-83-1 Molecular Formula: C13H10O Molecular Weight (g/mol): 182.222 MDL Number: MFCD00005055 InChI Key: GJCOSYZMQJWQCA-UHFFFAOYSA-N Synonym: xanthene,xanthan,10h-9-oxaanthracene,dibenzo a,e pyran,dibenzopyran, tricyclic,9h-xanthen,xanthane,9h-xanthen-9-yl,acmc-209rhu PubChem CID: 7107 ChEBI: CHEBI:10057 IUPAC Name: 9H-xanthene SMILES: C1C2=CC=CC=C2OC3=CC=CC=C31
| PubChem CID | 7107 |
|---|---|
| CAS | 92-83-1 |
| Molecular Weight (g/mol) | 182.222 |
| ChEBI | CHEBI:10057 |
| MDL Number | MFCD00005055 |
| SMILES | C1C2=CC=CC=C2OC3=CC=CC=C31 |
| Synonym | xanthene,xanthan,10h-9-oxaanthracene,dibenzo a,e pyran,dibenzopyran, tricyclic,9h-xanthen,xanthane,9h-xanthen-9-yl,acmc-209rhu |
| IUPAC Name | 9H-xanthene |
| InChI Key | GJCOSYZMQJWQCA-UHFFFAOYSA-N |
| Molecular Formula | C13H10O |
1-Cyano-4-(dimethylamino)pyridinium tetrafluoroborate, 98%
CAS: 59016-56-7 Molecular Formula: C8H10BF4N3 Molecular Weight (g/mol): 234.99 MDL Number: MFCD00011998 InChI Key: MBLVMDCQDCVKNE-UHFFFAOYSA-N Synonym: cdap,1-cyano-4-dimethylamino pyridinium tetrafluoroborate,1-cyano-4-dimethylamino pyridin-1-ium tetrafluoroborate,unii-p4w72066jt,1-cyano-4-dimethylamino-pyridinium tetrafluoroborate,pubchem17735,acmc-209m9a,n-cyano-4-dimethylaminopyridinium tetrafluoroborate,1-cyano-4-dimethylaminopyridinium tetra-fluoroborate,n-cyano-4-dimethylamino-pyridinium tetrafluoroborate PubChem CID: 9881151 IUPAC Name: 4-(dimethylamino)pyridin-1-ium-1-carbonitrile;tetrafluoroborate SMILES: F[B-](F)(F)F.CN(C)C1=CC=[N+](C=C1)C#N
| PubChem CID | 9881151 |
|---|---|
| CAS | 59016-56-7 |
| Molecular Weight (g/mol) | 234.99 |
| MDL Number | MFCD00011998 |
| SMILES | F[B-](F)(F)F.CN(C)C1=CC=[N+](C=C1)C#N |
| Synonym | cdap,1-cyano-4-dimethylamino pyridinium tetrafluoroborate,1-cyano-4-dimethylamino pyridin-1-ium tetrafluoroborate,unii-p4w72066jt,1-cyano-4-dimethylamino-pyridinium tetrafluoroborate,pubchem17735,acmc-209m9a,n-cyano-4-dimethylaminopyridinium tetrafluoroborate,1-cyano-4-dimethylaminopyridinium tetra-fluoroborate,n-cyano-4-dimethylamino-pyridinium tetrafluoroborate |
| IUPAC Name | 4-(dimethylamino)pyridin-1-ium-1-carbonitrile;tetrafluoroborate |
| InChI Key | MBLVMDCQDCVKNE-UHFFFAOYSA-N |
| Molecular Formula | C8H10BF4N3 |