Organoheterocyclic compounds
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2-Methoxy-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenol, 97%
CAS: 269410-22-2 Molecular Formula: C13H19BO4 Molecular Weight (g/mol): 250.10 MDL Number: MFCD02093723 InChI Key: WFSJROCEOJANPD-UHFFFAOYSA-N PubChem CID: 2734650 IUPAC Name: 2-methoxy-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenol SMILES: COC1=CC(=CC=C1O)B1OC(C)(C)C(C)(C)O1
| PubChem CID | 2734650 |
|---|---|
| CAS | 269410-22-2 |
| Molecular Weight (g/mol) | 250.10 |
| MDL Number | MFCD02093723 |
| SMILES | COC1=CC(=CC=C1O)B1OC(C)(C)C(C)(C)O1 |
| IUPAC Name | 2-methoxy-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenol |
| InChI Key | WFSJROCEOJANPD-UHFFFAOYSA-N |
| Molecular Formula | C13H19BO4 |
4H-Thieno[3,2-b]pyrrole-5-carboxylic acid, 97%, Thermo Scientific™
CAS: 39793-31-2 Molecular Formula: C7H5NO2S Molecular Weight (g/mol): 167.182 MDL Number: MFCD07368542 InChI Key: PMHDSACGRKBACK-UHFFFAOYSA-N Synonym: 4h-thieno 3,2-b pyrrole-5-carboxylic acid,4h-thieno 3,2-b pyrole-5-carboxylic acid,4wl,d-amino acid oxidase inhibitor,4h-thieno 3,2-b pyrrole-5-carboxylicacid,thiopheno 3,2-b pyrrole-5-carboxylic acid,4h-thieno 2,3-d pyrrole-5-carboxylic acid,4h-thieno 3 pound not2-b pyrrole-5-carboxylic acid PubChem CID: 4961254 IUPAC Name: 4H-thieno[3,2-b]pyrrole-5-carboxylic acid SMILES: C1=CSC2=C1NC(=C2)C(=O)O
| PubChem CID | 4961254 |
|---|---|
| CAS | 39793-31-2 |
| Molecular Weight (g/mol) | 167.182 |
| MDL Number | MFCD07368542 |
| SMILES | C1=CSC2=C1NC(=C2)C(=O)O |
| Synonym | 4h-thieno 3,2-b pyrrole-5-carboxylic acid,4h-thieno 3,2-b pyrole-5-carboxylic acid,4wl,d-amino acid oxidase inhibitor,4h-thieno 3,2-b pyrrole-5-carboxylicacid,thiopheno 3,2-b pyrrole-5-carboxylic acid,4h-thieno 2,3-d pyrrole-5-carboxylic acid,4h-thieno 3 pound not2-b pyrrole-5-carboxylic acid |
| IUPAC Name | 4H-thieno[3,2-b]pyrrole-5-carboxylic acid |
| InChI Key | PMHDSACGRKBACK-UHFFFAOYSA-N |
| Molecular Formula | C7H5NO2S |
4-(2-Oxo-1-pyrrolidinyl)benzaldehyde, 97%, Thermo Scientific™
CAS: 36151-45-8 Molecular Formula: C11H11NO2 Molecular Weight (g/mol): 189.214 MDL Number: MFCD00454011 InChI Key: VADZUJOCSAESJS-UHFFFAOYSA-N Synonym: 4-2-oxopyrrolidin-1-yl benzaldehyde,4-2-oxo-1-pyrrolidinyl benzaldehyde,4-2-oxo-pyrrolidin-1-yl-benzaldehyde,4-2-oxopyrrolidinyl benzaldehyde,benzaldehyde,4-2-oxo-1-pyrrolidinyl,4-2-oxo-pyrrolidin-1-yl benzaldehyde,4-2-oxidanylidenepyrrolidin-1-yl benzaldehyde PubChem CID: 2794706 IUPAC Name: 4-(2-oxopyrrolidin-1-yl)benzaldehyde SMILES: C1CC(=O)N(C1)C2=CC=C(C=C2)C=O
| PubChem CID | 2794706 |
|---|---|
| CAS | 36151-45-8 |
| Molecular Weight (g/mol) | 189.214 |
| MDL Number | MFCD00454011 |
| SMILES | C1CC(=O)N(C1)C2=CC=C(C=C2)C=O |
| Synonym | 4-2-oxopyrrolidin-1-yl benzaldehyde,4-2-oxo-1-pyrrolidinyl benzaldehyde,4-2-oxo-pyrrolidin-1-yl-benzaldehyde,4-2-oxopyrrolidinyl benzaldehyde,benzaldehyde,4-2-oxo-1-pyrrolidinyl,4-2-oxo-pyrrolidin-1-yl benzaldehyde,4-2-oxidanylidenepyrrolidin-1-yl benzaldehyde |
| IUPAC Name | 4-(2-oxopyrrolidin-1-yl)benzaldehyde |
| InChI Key | VADZUJOCSAESJS-UHFFFAOYSA-N |
| Molecular Formula | C11H11NO2 |
Ethyl 3-(2-furyl)-1-methyl-1H-pyrazole-5-carboxylate, 97%, Thermo Scientific™
CAS: 104295-62-7 Molecular Formula: C11H12N2O3 Molecular Weight (g/mol): 220.228 MDL Number: MFCD08271951 InChI Key: RMIOHJSPVQALON-UHFFFAOYSA-N Synonym: ethyl 3-2-furyl-1-methyl-1h-pyrazole-5-carboxylate,ethyl 5-furan-2-yl-2-methylpyrazole-3-carboxylate,5-ethoxycarbonyl-3-2-furyl-1-methylpyrazole,1h-pyrazole-5-carboxylicacid, 3-2-furanyl-1-methyl-, ethyl ester,acmc-1bsv1,ethyl 3-2-furyl-1-methylpyrazole-5-carboxylate,ethyl 3-furan-2-yl-1-methyl-1h-pyrazole-5-carboxylate,1-methyl-3-2-furyl-1h-pyrazole-5-carboxylic acid ethyl ester,1h-pyrazole-5-carboxylicacid,3-2-furanyl-1-methyl-,ethyl ester PubChem CID: 7537645 IUPAC Name: ethyl 5-(furan-2-yl)-2-methylpyrazole-3-carboxylate SMILES: CCOC(=O)C1=CC(=NN1C)C2=CC=CO2
| PubChem CID | 7537645 |
|---|---|
| CAS | 104295-62-7 |
| Molecular Weight (g/mol) | 220.228 |
| MDL Number | MFCD08271951 |
| SMILES | CCOC(=O)C1=CC(=NN1C)C2=CC=CO2 |
| Synonym | ethyl 3-2-furyl-1-methyl-1h-pyrazole-5-carboxylate,ethyl 5-furan-2-yl-2-methylpyrazole-3-carboxylate,5-ethoxycarbonyl-3-2-furyl-1-methylpyrazole,1h-pyrazole-5-carboxylicacid, 3-2-furanyl-1-methyl-, ethyl ester,acmc-1bsv1,ethyl 3-2-furyl-1-methylpyrazole-5-carboxylate,ethyl 3-furan-2-yl-1-methyl-1h-pyrazole-5-carboxylate,1-methyl-3-2-furyl-1h-pyrazole-5-carboxylic acid ethyl ester,1h-pyrazole-5-carboxylicacid,3-2-furanyl-1-methyl-,ethyl ester |
| IUPAC Name | ethyl 5-(furan-2-yl)-2-methylpyrazole-3-carboxylate |
| InChI Key | RMIOHJSPVQALON-UHFFFAOYSA-N |
| Molecular Formula | C11H12N2O3 |
Staurosporine, MP Biomedicals™
CAS: 62996-74-1 Molecular Formula: C28H26N4O3 Molecular Weight (g/mol): 466.541 InChI Key: HKSZLNNOFSGOKW-ZYSRIHRCSA-N Synonym: staurosporine,kinome_3629 PubChem CID: 49831000 SMILES: CC12C(C(CC(O1)N3C4=CC=CC=C4C5=C6C(=C7C8=CC=CC=C8N2C7=C53)CNC6=O)NC)OC
| PubChem CID | 49831000 |
|---|---|
| CAS | 62996-74-1 |
| Molecular Weight (g/mol) | 466.541 |
| SMILES | CC12C(C(CC(O1)N3C4=CC=CC=C4C5=C6C(=C7C8=CC=CC=C8N2C7=C53)CNC6=O)NC)OC |
| Synonym | staurosporine,kinome_3629 |
| InChI Key | HKSZLNNOFSGOKW-ZYSRIHRCSA-N |
| Molecular Formula | C28H26N4O3 |
Azepan-2-one oxime, 97%, Thermo Scientific™
CAS: 19214-08-5 Molecular Formula: C6H12N2O Molecular Weight (g/mol): 128.18 MDL Number: MFCD00053062 InChI Key: PPOHPUOKXMNCCI-UHFFFAOYSA-N Synonym: azepan-2-one oxime,n-azepan-2-ylidene hydroxylamine,2z-azepan-2-one oxime,2h-azepin-7-amine,3,4,5,6-tetrahydro-n-hydroxy,n-2e-azepan-2-ylidene hydroxylamine,2-hydroxyimino azaperhydroepine,n-2z-azepan-2-ylidene hydroxylamine,caprolactam-oxime,hieh@hpdeewafjjadp,azepan-2-oneoxime PubChem CID: 1810625 IUPAC Name: N-(3,4,5,6-tetrahydro-2H-azepin-7-yl)hydroxylamine SMILES: O\N=C1/CCCCCN1
| PubChem CID | 1810625 |
|---|---|
| CAS | 19214-08-5 |
| Molecular Weight (g/mol) | 128.18 |
| MDL Number | MFCD00053062 |
| SMILES | O\N=C1/CCCCCN1 |
| Synonym | azepan-2-one oxime,n-azepan-2-ylidene hydroxylamine,2z-azepan-2-one oxime,2h-azepin-7-amine,3,4,5,6-tetrahydro-n-hydroxy,n-2e-azepan-2-ylidene hydroxylamine,2-hydroxyimino azaperhydroepine,n-2z-azepan-2-ylidene hydroxylamine,caprolactam-oxime,hieh@hpdeewafjjadp,azepan-2-oneoxime |
| IUPAC Name | N-(3,4,5,6-tetrahydro-2H-azepin-7-yl)hydroxylamine |
| InChI Key | PPOHPUOKXMNCCI-UHFFFAOYSA-N |
| Molecular Formula | C6H12N2O |
4-(1H-1,2,4-triazol-1-ylmethyl)benzonitrile, ≥97%, Thermo Scientific™
CAS: 112809-25-3 Molecular Formula: C10H8N4 Molecular Weight (g/mol): 184.202 MDL Number: MFCD07368016 InChI Key: HQLYWHSJALKYOV-UHFFFAOYSA-N Synonym: 4-1h-1,2,4-triazol-1-ylmethyl benzonitrile,4-1h-1,2,4-triazol-1-yl methyl benzonitrile,4-1h-1,2,4-triazolylmethyl benzonitrile,4-1,2,4-triazol-1-ylmethyl benzonitrile,benzonitrile, 4-1h-1,2,4-triazol-1-ylmethyl,4-1,2,4-triazol-1-yl methyl benzonitrile,4-1-1,2,4-triazolyl methyl benzontrile,4-1,2,4-triazolylmethyl benzenecarbonitrile,letrozole impurity c PubChem CID: 7537616 IUPAC Name: 4-(1,2,4-triazol-1-ylmethyl)benzonitrile SMILES: C1=CC(=CC=C1CN2C=NC=N2)C#N
| PubChem CID | 7537616 |
|---|---|
| CAS | 112809-25-3 |
| Molecular Weight (g/mol) | 184.202 |
| MDL Number | MFCD07368016 |
| SMILES | C1=CC(=CC=C1CN2C=NC=N2)C#N |
| Synonym | 4-1h-1,2,4-triazol-1-ylmethyl benzonitrile,4-1h-1,2,4-triazol-1-yl methyl benzonitrile,4-1h-1,2,4-triazolylmethyl benzonitrile,4-1,2,4-triazol-1-ylmethyl benzonitrile,benzonitrile, 4-1h-1,2,4-triazol-1-ylmethyl,4-1,2,4-triazol-1-yl methyl benzonitrile,4-1-1,2,4-triazolyl methyl benzontrile,4-1,2,4-triazolylmethyl benzenecarbonitrile,letrozole impurity c |
| IUPAC Name | 4-(1,2,4-triazol-1-ylmethyl)benzonitrile |
| InChI Key | HQLYWHSJALKYOV-UHFFFAOYSA-N |
| Molecular Formula | C10H8N4 |
Tris(2,2'-bipyridine)dichlororuthenium(II) hexahydrate, 98+%
CAS: 50525-27-4 Molecular Formula: C30H36Cl2N6O6Ru Molecular Weight (g/mol): 748.62 MDL Number: MFCD00149670 InChI Key: WHELTKFSBJNBMQ-UHFFFAOYSA-L Synonym: tris 2,2'-bipyridyl ruthenium ii chloride hexahydrate PubChem CID: 131664161 IUPAC Name: 2-pyridin-2-ylpyridine;ruthenium(2+);dichloride;hydrate SMILES: O.O.O.O.O.O.[Cl-].[Cl-].[Ru++].C1=CN=C(C=C1)C1=NC=CC=C1.C1=CN=C(C=C1)C1=NC=CC=C1.C1=CN=C(C=C1)C1=NC=CC=C1
| PubChem CID | 131664161 |
|---|---|
| CAS | 50525-27-4 |
| Molecular Weight (g/mol) | 748.62 |
| MDL Number | MFCD00149670 |
| SMILES | O.O.O.O.O.O.[Cl-].[Cl-].[Ru++].C1=CN=C(C=C1)C1=NC=CC=C1.C1=CN=C(C=C1)C1=NC=CC=C1.C1=CN=C(C=C1)C1=NC=CC=C1 |
| Synonym | tris 2,2'-bipyridyl ruthenium ii chloride hexahydrate |
| IUPAC Name | 2-pyridin-2-ylpyridine;ruthenium(2+);dichloride;hydrate |
| InChI Key | WHELTKFSBJNBMQ-UHFFFAOYSA-L |
| Molecular Formula | C30H36Cl2N6O6Ru |
Tetrahydrothiopyran-4-ylmethanol, 97%, Thermo Scientific™
CAS: 100277-27-8 Molecular Formula: C6H12OS Molecular Weight (g/mol): 132.221 MDL Number: MFCD09966150 InChI Key: LMVCLDAMMNHILO-UHFFFAOYSA-N Synonym: tetrahydro-2h-thiopyran-4-yl methanol,tetrahydrothiopyran-4-methanol,tetrahydrothiopyran-4-ylmethanol,thian-4-yl methanol,2h-thiopyran-4-methanol, tetrahydro,2h-thiopyran-4-methanol,tetrahydro,4-hydroxymethyl tetrahydro-2h-thiopyran,acmc-20dmhk,thian-4-ylmethan-1-ol,4-hydroxymethyl thiane PubChem CID: 20143654 IUPAC Name: thian-4-ylmethanol SMILES: C1CSCCC1CO
| PubChem CID | 20143654 |
|---|---|
| CAS | 100277-27-8 |
| Molecular Weight (g/mol) | 132.221 |
| MDL Number | MFCD09966150 |
| SMILES | C1CSCCC1CO |
| Synonym | tetrahydro-2h-thiopyran-4-yl methanol,tetrahydrothiopyran-4-methanol,tetrahydrothiopyran-4-ylmethanol,thian-4-yl methanol,2h-thiopyran-4-methanol, tetrahydro,2h-thiopyran-4-methanol,tetrahydro,4-hydroxymethyl tetrahydro-2h-thiopyran,acmc-20dmhk,thian-4-ylmethan-1-ol,4-hydroxymethyl thiane |
| IUPAC Name | thian-4-ylmethanol |
| InChI Key | LMVCLDAMMNHILO-UHFFFAOYSA-N |
| Molecular Formula | C6H12OS |
Iron(II) phthalocyanine, 96%
CAS: 132-16-1 Molecular Formula: C32H16FeN8 Molecular Weight (g/mol): 568.38 MDL Number: MFCD00015953 InChI Key: MIINHRNQLVVCEW-UHFFFAOYSA-N Synonym: iron phthalocyanine,iron ii phthalocyanine,ferrous phthalocyanine,phthalocyanine iron ii,fepc,29h,31h-phthalocyaninato 2--n29,n30,n31,n32 iron,iron, 29h,31h-phthalocyaninato 2--n29,n39,n31,n32-, sp-4-1,iron, 29h,31h-phthalocyaninato 2--kappan29,kappan30,kappan31,kappan32-, sp-4-1 PubChem CID: 2735065 IUPAC Name: λ²-iron(2+) 2,11,20,29,37,38,39,40-octaazanonacyclo[28.6.1.1³,¹⁰.1¹²,¹⁹.1²¹,²⁸.0⁴,⁹.0¹³,¹⁸.0²²,²⁷.0³¹,³⁶]tetraconta-1(36),2,4,6,8,10(40),11,13,15,17,19,21(38),22,24,26,28,30,32,34-nonadecaene-37,39-diide SMILES: [Fe++].[N-]1C2=NC3=NC(=NC4=C5C=CC=CC5=C([N-]4)N=C4N=C(N=C1C1=CC=CC=C21)C1=CC=CC=C41)C1=CC=CC=C31
| PubChem CID | 2735065 |
|---|---|
| CAS | 132-16-1 |
| Molecular Weight (g/mol) | 568.38 |
| MDL Number | MFCD00015953 |
| SMILES | [Fe++].[N-]1C2=NC3=NC(=NC4=C5C=CC=CC5=C([N-]4)N=C4N=C(N=C1C1=CC=CC=C21)C1=CC=CC=C41)C1=CC=CC=C31 |
| Synonym | iron phthalocyanine,iron ii phthalocyanine,ferrous phthalocyanine,phthalocyanine iron ii,fepc,29h,31h-phthalocyaninato 2--n29,n30,n31,n32 iron,iron, 29h,31h-phthalocyaninato 2--n29,n39,n31,n32-, sp-4-1,iron, 29h,31h-phthalocyaninato 2--kappan29,kappan30,kappan31,kappan32-, sp-4-1 |
| IUPAC Name | λ²-iron(2+) 2,11,20,29,37,38,39,40-octaazanonacyclo[28.6.1.1³,¹⁰.1¹²,¹⁹.1²¹,²⁸.0⁴,⁹.0¹³,¹⁸.0²²,²⁷.0³¹,³⁶]tetraconta-1(36),2,4,6,8,10(40),11,13,15,17,19,21(38),22,24,26,28,30,32,34-nonadecaene-37,39-diide |
| InChI Key | MIINHRNQLVVCEW-UHFFFAOYSA-N |
| Molecular Formula | C32H16FeN8 |
Meloxicam Impurity Standard, British Pharmacopoeia (BP) Reference Standard, MilliporeSigma™ Supelco™
This product is provided as delivered and specified by the issuing Pharmacopoeia. All information provided in support of this product, including SDS and any product information leaflets, has been developed and issued under the Authority of the issuing Pharmacopoeia.
Nitrofurfural Diacetate, British Pharmacopoeia (BP) Reference Standard, MilliporeSigma™ Supelco™
This product is provided as delivered and specified by the issuing Pharmacopoeia. All information provided in support of this product, including SDS and any product information leaflets, has been developed and issued under the Authority of the issuing Pharmacopoeia.
Ethyl 2,4-dichloro-6-methylnicotinate, 97%, Thermo Scientific™
CAS: 86129-63-7 Molecular Formula: C9H9Cl2NO2 Molecular Weight (g/mol): 234.076 MDL Number: MFCD00173918 InChI Key: ZNFJVVLTQSOWJY-UHFFFAOYSA-N Synonym: ethyl 2,4-dichloro-6-methylnicotinate,ethyl 2,4-dichloro-6-methyl-3-pyridinecarboxylate,2,4-dichloro-6-methyl-nicotinic acid ethyl ester,3-pyridinecarboxylic acid, 2,4-dichloro-6-methyl-, ethyl ester,ethyl2,4-dichloro-6-methylnicotinate,ethyl 2,4-dichloro-6-methyl nicotinate,ethyl 2,4-dichloro-6-methylnicotinate #,2,4-dichloro-6-methylnicotinic acid ethyl ester,ethyl 2,4-dichloro-6-methyl-pyridine-3-carboxylate,3-pyridinecarboxylicacid,2,4-dichloro-6-methyl-,ethylester PubChem CID: 604813 IUPAC Name: ethyl 2,4-dichloro-6-methylpyridine-3-carboxylate SMILES: CCOC(=O)C1=C(N=C(C=C1Cl)C)Cl
| PubChem CID | 604813 |
|---|---|
| CAS | 86129-63-7 |
| Molecular Weight (g/mol) | 234.076 |
| MDL Number | MFCD00173918 |
| SMILES | CCOC(=O)C1=C(N=C(C=C1Cl)C)Cl |
| Synonym | ethyl 2,4-dichloro-6-methylnicotinate,ethyl 2,4-dichloro-6-methyl-3-pyridinecarboxylate,2,4-dichloro-6-methyl-nicotinic acid ethyl ester,3-pyridinecarboxylic acid, 2,4-dichloro-6-methyl-, ethyl ester,ethyl2,4-dichloro-6-methylnicotinate,ethyl 2,4-dichloro-6-methyl nicotinate,ethyl 2,4-dichloro-6-methylnicotinate #,2,4-dichloro-6-methylnicotinic acid ethyl ester,ethyl 2,4-dichloro-6-methyl-pyridine-3-carboxylate,3-pyridinecarboxylicacid,2,4-dichloro-6-methyl-,ethylester |
| IUPAC Name | ethyl 2,4-dichloro-6-methylpyridine-3-carboxylate |
| InChI Key | ZNFJVVLTQSOWJY-UHFFFAOYSA-N |
| Molecular Formula | C9H9Cl2NO2 |
5-Bromo-3-methylpyridin-2-amine, 97%, Thermo Scientific™
CAS: 3430-21-5 Molecular Formula: C6H7BrN2 Molecular Weight (g/mol): 187.04 InChI Key: KBLGGRWUEVCNPY-UHFFFAOYSA-N Synonym: 2-amino-5-bromo-3-methylpyridine,2-amino-5-bromo-3-picoline,2-amino-3-methyl-5-bromopyridine,5-bromo-3-methyl-pyridin-2-ylamine,2-pyridinamine, 5-bromo-3-methyl,5-bromo-3-methyl-2-pyridinamine,2-amina-5-bromo-3-picoline,5-bromo-3-methyl-2-pyridylamine,5-bromo-3-methyl-pyridin-2-amine,5-bromo-3-methylpyridin-2-ylamine PubChem CID: 137934 IUPAC Name: 5-bromo-3-methylpyridin-2-amine SMILES: CC1=CC(=CN=C1N)Br
| PubChem CID | 137934 |
|---|---|
| CAS | 3430-21-5 |
| Molecular Weight (g/mol) | 187.04 |
| SMILES | CC1=CC(=CN=C1N)Br |
| Synonym | 2-amino-5-bromo-3-methylpyridine,2-amino-5-bromo-3-picoline,2-amino-3-methyl-5-bromopyridine,5-bromo-3-methyl-pyridin-2-ylamine,2-pyridinamine, 5-bromo-3-methyl,5-bromo-3-methyl-2-pyridinamine,2-amina-5-bromo-3-picoline,5-bromo-3-methyl-2-pyridylamine,5-bromo-3-methyl-pyridin-2-amine,5-bromo-3-methylpyridin-2-ylamine |
| IUPAC Name | 5-bromo-3-methylpyridin-2-amine |
| InChI Key | KBLGGRWUEVCNPY-UHFFFAOYSA-N |
| Molecular Formula | C6H7BrN2 |