Organoheterocyclic compounds
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4-Pyrimidin-2-ylbenzonitrile, 95%, Thermo Scientific™
CAS: 78322-96-0 Molecular Formula: C11H7N3 Molecular Weight (g/mol): 181.198 MDL Number: MFCD09817491 InChI Key: WGCKVXHOTDDNOA-UHFFFAOYSA-N Synonym: 4-pyrimidin-2-yl benzonitrile,4-cyanophenyl pyrimidine,2-4-cyanophenyl pyrimidine,4-pyrimidin-2-yl-benzonitrile,4-2-pyrimidinyl benzonitrile,benzonitrile, 4-2-pyrimidinyl,4-pyrimidin-2-ylbenzenecarbonitrile PubChem CID: 15486310 IUPAC Name: 4-pyrimidin-2-ylbenzonitrile SMILES: C1=CN=C(N=C1)C2=CC=C(C=C2)C#N
| PubChem CID | 15486310 |
|---|---|
| CAS | 78322-96-0 |
| Molecular Weight (g/mol) | 181.198 |
| MDL Number | MFCD09817491 |
| SMILES | C1=CN=C(N=C1)C2=CC=C(C=C2)C#N |
| Synonym | 4-pyrimidin-2-yl benzonitrile,4-cyanophenyl pyrimidine,2-4-cyanophenyl pyrimidine,4-pyrimidin-2-yl-benzonitrile,4-2-pyrimidinyl benzonitrile,benzonitrile, 4-2-pyrimidinyl,4-pyrimidin-2-ylbenzenecarbonitrile |
| IUPAC Name | 4-pyrimidin-2-ylbenzonitrile |
| InChI Key | WGCKVXHOTDDNOA-UHFFFAOYSA-N |
| Molecular Formula | C11H7N3 |
2-n-Pentylfuran, 98%
CAS: 3777-69-3 Molecular Formula: C9H14O Molecular Weight (g/mol): 138.21 MDL Number: MFCD00036497 InChI Key: YVBAUDVGOFCUSG-UHFFFAOYSA-N Synonym: furan, 2-pentyl,2-n-pentylfuran,2-amylfuran,furan, pentyl,pentylfuran,natural,unii-6i0qaj1jzq,2-pentyl furan,fema no. 3317,6i0qaj1jzq PubChem CID: 19602 IUPAC Name: 2-pentylfuran SMILES: CCCCCC1=CC=CO1
| PubChem CID | 19602 |
|---|---|
| CAS | 3777-69-3 |
| Molecular Weight (g/mol) | 138.21 |
| MDL Number | MFCD00036497 |
| SMILES | CCCCCC1=CC=CO1 |
| Synonym | furan, 2-pentyl,2-n-pentylfuran,2-amylfuran,furan, pentyl,pentylfuran,natural,unii-6i0qaj1jzq,2-pentyl furan,fema no. 3317,6i0qaj1jzq |
| IUPAC Name | 2-pentylfuran |
| InChI Key | YVBAUDVGOFCUSG-UHFFFAOYSA-N |
| Molecular Formula | C9H14O |
3-Furanmethanol, 99%
CAS: 4412-91-3 Molecular Formula: C5H6O2 Molecular Weight (g/mol): 98.10 MDL Number: MFCD00005352 InChI Key: STJIISDMSMJQQK-UHFFFAOYSA-N Synonym: 3-furanmethanol,furan-3-methanol,3-furylmethanol,3-hydroxymethyl furan,3-furfuryl alcohol,3-hydroxymethylfuran,3-furyl alcohol,furan-3-yl-methanol,furan-3-yl methanol,3-hydroxymethyl-furan PubChem CID: 20449 IUPAC Name: furan-3-ylmethanol SMILES: OCC1=COC=C1
| PubChem CID | 20449 |
|---|---|
| CAS | 4412-91-3 |
| Molecular Weight (g/mol) | 98.10 |
| MDL Number | MFCD00005352 |
| SMILES | OCC1=COC=C1 |
| Synonym | 3-furanmethanol,furan-3-methanol,3-furylmethanol,3-hydroxymethyl furan,3-furfuryl alcohol,3-hydroxymethylfuran,3-furyl alcohol,furan-3-yl-methanol,furan-3-yl methanol,3-hydroxymethyl-furan |
| IUPAC Name | furan-3-ylmethanol |
| InChI Key | STJIISDMSMJQQK-UHFFFAOYSA-N |
| Molecular Formula | C5H6O2 |
Benzimidazole-6-carbonitrile, 97%, Thermo Scientific Chemicals
CAS: 6287-83-8 Molecular Formula: C8H5N3 Molecular Weight (g/mol): 143.15 MDL Number: MFCD06809988 InChI Key: NICYTXJGZRYCEQ-UHFFFAOYSA-N Synonym: 1h-benzimidazole-5-carbonitrile,1h-benzo d imidazole-6-carbonitrile,1h-1,3-benzodiazole-5-carbonitrile,1h-benzo d imidazole-5-carbonitrile,5-cyanobenzimidazole,1h-benzimidazole-6-carbonitrile,5-benzimidazolecarbonitrile,benzimidazole-5-carbonitrile,1h-benzoimidazole-5-carbonitrile,3h-1,3-benzodiazole-5-carbonitrile PubChem CID: 223906 IUPAC Name: 1H-1,3-benzodiazole-6-carbonitrile SMILES: N#CC1=CC=C2N=CNC2=C1
| PubChem CID | 223906 |
|---|---|
| CAS | 6287-83-8 |
| Molecular Weight (g/mol) | 143.15 |
| MDL Number | MFCD06809988 |
| SMILES | N#CC1=CC=C2N=CNC2=C1 |
| Synonym | 1h-benzimidazole-5-carbonitrile,1h-benzo d imidazole-6-carbonitrile,1h-1,3-benzodiazole-5-carbonitrile,1h-benzo d imidazole-5-carbonitrile,5-cyanobenzimidazole,1h-benzimidazole-6-carbonitrile,5-benzimidazolecarbonitrile,benzimidazole-5-carbonitrile,1h-benzoimidazole-5-carbonitrile,3h-1,3-benzodiazole-5-carbonitrile |
| IUPAC Name | 1H-1,3-benzodiazole-6-carbonitrile |
| InChI Key | NICYTXJGZRYCEQ-UHFFFAOYSA-N |
| Molecular Formula | C8H5N3 |
2,5-Dimethylpyrazine, 99%
CAS: 123-32-0 Molecular Formula: C6H8N2 Molecular Weight (g/mol): 108.14 MDL Number: MFCD00006147 InChI Key: LCZUOKDVTBMCMX-UHFFFAOYSA-N Synonym: 2,5-dimethyl pyrazine,pyrazine, 2,5-dimethyl,2,5-dimethylpiazine,2,5-dimethyl-1,4-diazine,2,5-dimethylparadiazine,2,5-dimethyl-pyrazine,unii-v99y0muy1q,fema no. 3272,ccris 2929,natural PubChem CID: 31252 IUPAC Name: 2,5-dimethylpyrazine SMILES: CC1=CN=C(C=N1)C
| PubChem CID | 31252 |
|---|---|
| CAS | 123-32-0 |
| Molecular Weight (g/mol) | 108.14 |
| MDL Number | MFCD00006147 |
| SMILES | CC1=CN=C(C=N1)C |
| Synonym | 2,5-dimethyl pyrazine,pyrazine, 2,5-dimethyl,2,5-dimethylpiazine,2,5-dimethyl-1,4-diazine,2,5-dimethylparadiazine,2,5-dimethyl-pyrazine,unii-v99y0muy1q,fema no. 3272,ccris 2929,natural |
| IUPAC Name | 2,5-dimethylpyrazine |
| InChI Key | LCZUOKDVTBMCMX-UHFFFAOYSA-N |
| Molecular Formula | C6H8N2 |
Tris(8-hydroxyquinolinato)aluminum, 99%
CAS: 2085-33-8 MDL Number: MFCD00191693 Synonym: tri-8-quinolinolatoaluminum,aluminum 8-hydroxyquinolinate,tri quinolin-8-yloxy alumane,aluminum tris quinolin-8-olate,tris 8-hydroxyquinolinato aluminum,aluminum, tris 8-quinolinato-n1,o8,aluminum oxinate,aluminum oxinate,,tris 8-quinolyloxy alumane,tris 8-quinolinyloxy alumane
| CAS | 2085-33-8 |
|---|---|
| MDL Number | MFCD00191693 |
| Synonym | tri-8-quinolinolatoaluminum,aluminum 8-hydroxyquinolinate,tri quinolin-8-yloxy alumane,aluminum tris quinolin-8-olate,tris 8-hydroxyquinolinato aluminum,aluminum, tris 8-quinolinato-n1,o8,aluminum oxinate,aluminum oxinate,,tris 8-quinolyloxy alumane,tris 8-quinolinyloxy alumane |
Imidazole, Reagent, 99%, Spectrum™ Chemical
CAS: 288-32-4 Molecular Formula: C3H4N2 Molecular Weight (g/mol): 68.08 MDL Number: MFCD00005183 InChI Key: RAXXELZNTBOGNW-UHFFFAOYSA-N IUPAC Name: 1H-imidazole SMILES: N1C=CN=C1
| CAS | 288-32-4 |
|---|---|
| Molecular Weight (g/mol) | 68.08 |
| MDL Number | MFCD00005183 |
| SMILES | N1C=CN=C1 |
| IUPAC Name | 1H-imidazole |
| InChI Key | RAXXELZNTBOGNW-UHFFFAOYSA-N |
| Molecular Formula | C3H4N2 |
2-Methylbenzothiazole, 99%
CAS: 120-75-2 Molecular Formula: C8H7NS Molecular Weight (g/mol): 149.21 InChI Key: DXYYSGDWQCSKKO-UHFFFAOYSA-N Synonym: 2-methylbenzothiazole,benzothiazole, 2-methyl,2-methybenzothiazole,2-methyl-benzothiazole,benzothiazole, methyl,usaf ek-1853,unii-7lx1xe6h8w,2-methylbenzo d thiazole,2-methyl benzothiazole,7lx1xe6h8w PubChem CID: 8446 IUPAC Name: 2-methyl-1,3-benzothiazole SMILES: CC1=NC2=CC=CC=C2S1
| PubChem CID | 8446 |
|---|---|
| CAS | 120-75-2 |
| Molecular Weight (g/mol) | 149.21 |
| SMILES | CC1=NC2=CC=CC=C2S1 |
| Synonym | 2-methylbenzothiazole,benzothiazole, 2-methyl,2-methybenzothiazole,2-methyl-benzothiazole,benzothiazole, methyl,usaf ek-1853,unii-7lx1xe6h8w,2-methylbenzo d thiazole,2-methyl benzothiazole,7lx1xe6h8w |
| IUPAC Name | 2-methyl-1,3-benzothiazole |
| InChI Key | DXYYSGDWQCSKKO-UHFFFAOYSA-N |
| Molecular Formula | C8H7NS |
2-Amino-5-tert-butyl-1,3,4-thiadiazole, 97%
CAS: 39222-73-6 Molecular Formula: C6H11N3S Molecular Weight (g/mol): 157.24 MDL Number: MFCD00040403 InChI Key: ICXDPEFCLDSXLI-UHFFFAOYSA-N Synonym: 2-amino-5-tert-butyl-1,3,4-thiadiazole,buthidazolamine,5-tert-butyl-1,3,4-thiadiazol-2-amine,1,3,4-thiadiazol-2-amine, 5-1,1-dimethylethyl,unii-x53j1t94sn,5-tert-butyl-1,3,4 thiadiazol-2-ylamine,5-tert-butyl-1,3,4-thiadiazole-2-ylamine,acmc-20aidm,enamine_005678,5-t-butyl-2-amino1,3,4-thiadiazole PubChem CID: 170170 IUPAC Name: 5-tert-butyl-1,3,4-thiadiazol-2-amine SMILES: CC(C)(C)C1=NN=C(N)S1
| PubChem CID | 170170 |
|---|---|
| CAS | 39222-73-6 |
| Molecular Weight (g/mol) | 157.24 |
| MDL Number | MFCD00040403 |
| SMILES | CC(C)(C)C1=NN=C(N)S1 |
| Synonym | 2-amino-5-tert-butyl-1,3,4-thiadiazole,buthidazolamine,5-tert-butyl-1,3,4-thiadiazol-2-amine,1,3,4-thiadiazol-2-amine, 5-1,1-dimethylethyl,unii-x53j1t94sn,5-tert-butyl-1,3,4 thiadiazol-2-ylamine,5-tert-butyl-1,3,4-thiadiazole-2-ylamine,acmc-20aidm,enamine_005678,5-t-butyl-2-amino1,3,4-thiadiazole |
| IUPAC Name | 5-tert-butyl-1,3,4-thiadiazol-2-amine |
| InChI Key | ICXDPEFCLDSXLI-UHFFFAOYSA-N |
| Molecular Formula | C6H11N3S |
3,5-Diphenylpyrazole, 99%
CAS: 1145-01-3 Molecular Formula: C15H12N2 Molecular Weight (g/mol): 220.28 MDL Number: MFCD00039675 InChI Key: JXHKUYQCEJILEI-UHFFFAOYSA-N Synonym: 3,5-diphenylpyrazole,1h-pyrazole, 3,5-diphenyl,pyrazole, 3,5-diphenyl,pyrazole,5-diphenyl,acmc-1bufo,1h-pyrazole,5-diphenyl,cbmicro_048085,3,5-diphenyl pyrazole,3,5-diphenyl-1h-pyrazole 5g PubChem CID: 70840 IUPAC Name: 3,5-diphenyl-1H-pyrazole SMILES: N1N=C(C=C1C1=CC=CC=C1)C1=CC=CC=C1
| PubChem CID | 70840 |
|---|---|
| CAS | 1145-01-3 |
| Molecular Weight (g/mol) | 220.28 |
| MDL Number | MFCD00039675 |
| SMILES | N1N=C(C=C1C1=CC=CC=C1)C1=CC=CC=C1 |
| Synonym | 3,5-diphenylpyrazole,1h-pyrazole, 3,5-diphenyl,pyrazole, 3,5-diphenyl,pyrazole,5-diphenyl,acmc-1bufo,1h-pyrazole,5-diphenyl,cbmicro_048085,3,5-diphenyl pyrazole,3,5-diphenyl-1h-pyrazole 5g |
| IUPAC Name | 3,5-diphenyl-1H-pyrazole |
| InChI Key | JXHKUYQCEJILEI-UHFFFAOYSA-N |
| Molecular Formula | C15H12N2 |
Thiophene-2-boronic acid, 97%
CAS: 6165-68-0 Molecular Formula: C4H5BO2S Molecular Weight (g/mol): 127.95 MDL Number: MFCD00151850 InChI Key: ARYHTUPFQTUBBG-UHFFFAOYSA-N Synonym: thiophene-2-boronic acid,2-thiopheneboronic acid,2-thienylboronic acid,thienylboronic acid,2-thiopheneboronicacid,thiophen-2-ylboranediol,thiophene2-boronic acid,thiophen-2-yl boronic acid,2-thiophenylboric acid,boronic acid, thienyl PubChem CID: 2733960 IUPAC Name: thiophen-2-ylboronic acid SMILES: OB(O)C1=CC=CS1
| PubChem CID | 2733960 |
|---|---|
| CAS | 6165-68-0 |
| Molecular Weight (g/mol) | 127.95 |
| MDL Number | MFCD00151850 |
| SMILES | OB(O)C1=CC=CS1 |
| Synonym | thiophene-2-boronic acid,2-thiopheneboronic acid,2-thienylboronic acid,thienylboronic acid,2-thiopheneboronicacid,thiophen-2-ylboranediol,thiophene2-boronic acid,thiophen-2-yl boronic acid,2-thiophenylboric acid,boronic acid, thienyl |
| IUPAC Name | thiophen-2-ylboronic acid |
| InChI Key | ARYHTUPFQTUBBG-UHFFFAOYSA-N |
| Molecular Formula | C4H5BO2S |
2-Thiopheneacetyl chloride, 99%
CAS: 39098-97-0 Molecular Formula: C6H5ClOS Molecular Weight (g/mol): 160.62 MDL Number: MFCD00005456 InChI Key: AJYXPNIENRLELY-UHFFFAOYSA-N Synonym: 2-thiopheneacetyl chloride,2-thiophen-2-yl acetyl chloride,2-thienylacetyl chloride,2-thiophene acetyl chloride,thiophene-2-acetyl chloride,2-2-thienyl acetyl chloride,thiopheneacetyl chloride,2-thiopheneacetylchloride,thienylacetyl chloride,thien-2-ylacetyl chloride PubChem CID: 162362 IUPAC Name: 2-thiophen-2-ylacetyl chloride SMILES: C1=CSC(=C1)CC(=O)Cl
| PubChem CID | 162362 |
|---|---|
| CAS | 39098-97-0 |
| Molecular Weight (g/mol) | 160.62 |
| MDL Number | MFCD00005456 |
| SMILES | C1=CSC(=C1)CC(=O)Cl |
| Synonym | 2-thiopheneacetyl chloride,2-thiophen-2-yl acetyl chloride,2-thienylacetyl chloride,2-thiophene acetyl chloride,thiophene-2-acetyl chloride,2-2-thienyl acetyl chloride,thiopheneacetyl chloride,2-thiopheneacetylchloride,thienylacetyl chloride,thien-2-ylacetyl chloride |
| IUPAC Name | 2-thiophen-2-ylacetyl chloride |
| InChI Key | AJYXPNIENRLELY-UHFFFAOYSA-N |
| Molecular Formula | C6H5ClOS |
3,5-Dimethyl-1-phenyl-1H-pyrazole-4-carbonitrile, ≥97%, Thermo Scientific™
CAS: 23198-55-2 Molecular Formula: C12H11N3 Molecular Weight (g/mol): 197.241 MDL Number: MFCD08435888 InChI Key: WOFAIVGOIVCZJJ-UHFFFAOYSA-N Synonym: 3,5-dimethyl-1-phenyl-1h-pyrazole-4-carbonitrile,1h-pyrazole-4-carbonitrile,3,5-dimethyl-1-phenyl PubChem CID: 12208701 IUPAC Name: 3,5-dimethyl-1-phenylpyrazole-4-carbonitrile SMILES: CC1=C(C(=NN1C2=CC=CC=C2)C)C#N
| PubChem CID | 12208701 |
|---|---|
| CAS | 23198-55-2 |
| Molecular Weight (g/mol) | 197.241 |
| MDL Number | MFCD08435888 |
| SMILES | CC1=C(C(=NN1C2=CC=CC=C2)C)C#N |
| Synonym | 3,5-dimethyl-1-phenyl-1h-pyrazole-4-carbonitrile,1h-pyrazole-4-carbonitrile,3,5-dimethyl-1-phenyl |
| IUPAC Name | 3,5-dimethyl-1-phenylpyrazole-4-carbonitrile |
| InChI Key | WOFAIVGOIVCZJJ-UHFFFAOYSA-N |
| Molecular Formula | C12H11N3 |
Quinoxaline, 98+%, Thermo Scientific Chemicals
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 |
2-Thiophenemethanol, 97%
CAS: 636-72-6 Molecular Formula: C5H6OS Molecular Weight (g/mol): 114.16 MDL Number: MFCD00005454 InChI Key: ZPHGMBGIFODUMF-UHFFFAOYSA-N Synonym: 2-thiophenemethanol,thiophene-2-methanol,2-thienylmethanol,2-hydroxymethylthiophene,2-thenyl alcohol,2-hydroxymethyl thiophene,thenyl alcohol,2-thiophenecarbinol,thien-2-yl methanol,thiophen-2-yl methanol PubChem CID: 69467 IUPAC Name: thiophen-2-ylmethanol SMILES: OCC1=CC=CS1
| PubChem CID | 69467 |
|---|---|
| CAS | 636-72-6 |
| Molecular Weight (g/mol) | 114.16 |
| MDL Number | MFCD00005454 |
| SMILES | OCC1=CC=CS1 |
| Synonym | 2-thiophenemethanol,thiophene-2-methanol,2-thienylmethanol,2-hydroxymethylthiophene,2-thenyl alcohol,2-hydroxymethyl thiophene,thenyl alcohol,2-thiophenecarbinol,thien-2-yl methanol,thiophen-2-yl methanol |
| IUPAC Name | thiophen-2-ylmethanol |
| InChI Key | ZPHGMBGIFODUMF-UHFFFAOYSA-N |
| Molecular Formula | C5H6OS |