Organoheterocyclic compounds
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Ticarcillin Impurity B, 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.
Pyrrole-2-carbonitrile, 97%
CAS: 4513-94-4 Molecular Formula: C5H4N2 Molecular Weight (g/mol): 92.10 MDL Number: MFCD00234061 InChI Key: BQMPGKPTOHKYHS-UHFFFAOYSA-N Synonym: pyrrole-2-carbonitrile,2-cyanopyrrole,unii-6d25bmc1pp,2-carbonitrilepyrrole,6d25bmc1pp,cyanopyrrole,2-cyano-pyrrol,pyrrole carbonitrile,1h-pyrrolecarbonitrile,1h-pyrrol-2-kohlenitrile PubChem CID: 138277 IUPAC Name: 1H-pyrrole-2-carbonitrile SMILES: N#CC1=CC=CN1
| PubChem CID | 138277 |
|---|---|
| CAS | 4513-94-4 |
| Molecular Weight (g/mol) | 92.10 |
| MDL Number | MFCD00234061 |
| SMILES | N#CC1=CC=CN1 |
| Synonym | pyrrole-2-carbonitrile,2-cyanopyrrole,unii-6d25bmc1pp,2-carbonitrilepyrrole,6d25bmc1pp,cyanopyrrole,2-cyano-pyrrol,pyrrole carbonitrile,1h-pyrrolecarbonitrile,1h-pyrrol-2-kohlenitrile |
| IUPAC Name | 1H-pyrrole-2-carbonitrile |
| InChI Key | BQMPGKPTOHKYHS-UHFFFAOYSA-N |
| Molecular Formula | C5H4N2 |
Benzoguanamine, 99%
CAS: 91-76-9 Molecular Formula: C9H9N5 Molecular Weight (g/mol): 187.21 MDL Number: MFCD00023187 InChI Key: GZVHEAJQGPRDLQ-UHFFFAOYSA-N Synonym: benzoguanamine,2,4-diamino-6-phenyl-1,3,5-triazine,benzoguanimine,1,3,5-triazine-2,4-diamine, 6-phenyl,usaf rh-5,2,4-diamino-6-phenyl-s-triazine,2-phenyl-4,6-diamino-s-triazine,4,6-diamino-2-phenyl-s-triazine,benzoguanamine van,s-triazine, 2,4-diamino-6-phenyl PubChem CID: 7064 IUPAC Name: 6-phenyl-1,3,5-triazine-2,4-diamine SMILES: NC1=NC(=NC(N)=N1)C1=CC=CC=C1
| PubChem CID | 7064 |
|---|---|
| CAS | 91-76-9 |
| Molecular Weight (g/mol) | 187.21 |
| MDL Number | MFCD00023187 |
| SMILES | NC1=NC(=NC(N)=N1)C1=CC=CC=C1 |
| Synonym | benzoguanamine,2,4-diamino-6-phenyl-1,3,5-triazine,benzoguanimine,1,3,5-triazine-2,4-diamine, 6-phenyl,usaf rh-5,2,4-diamino-6-phenyl-s-triazine,2-phenyl-4,6-diamino-s-triazine,4,6-diamino-2-phenyl-s-triazine,benzoguanamine van,s-triazine, 2,4-diamino-6-phenyl |
| IUPAC Name | 6-phenyl-1,3,5-triazine-2,4-diamine |
| InChI Key | GZVHEAJQGPRDLQ-UHFFFAOYSA-N |
| Molecular Formula | C9H9N5 |
2-Phenylthiophene, 95%
CAS: 825-55-8 Molecular Formula: C10H8S Molecular Weight (g/mol): 160.234 MDL Number: MFCD00130080 InChI Key: PJRGDKFLFAYRBV-UHFFFAOYSA-N Synonym: thiophene, 2-phenyl,2-phenyl-thiophene,phenylthiophene,thiophene, phenyl,2-thienylbenzene,2-phenyithiophene,2-phenylthiofuran,2-phenylthiophene,acmc-209ppe PubChem CID: 69999 IUPAC Name: 2-phenylthiophene SMILES: C1=CC=C(C=C1)C2=CC=CS2
| PubChem CID | 69999 |
|---|---|
| CAS | 825-55-8 |
| Molecular Weight (g/mol) | 160.234 |
| MDL Number | MFCD00130080 |
| SMILES | C1=CC=C(C=C1)C2=CC=CS2 |
| Synonym | thiophene, 2-phenyl,2-phenyl-thiophene,phenylthiophene,thiophene, phenyl,2-thienylbenzene,2-phenyithiophene,2-phenylthiofuran,2-phenylthiophene,acmc-209ppe |
| IUPAC Name | 2-phenylthiophene |
| InChI Key | PJRGDKFLFAYRBV-UHFFFAOYSA-N |
| Molecular Formula | C10H8S |
2-n-Butylthiophene, 98+%
CAS: 1455-20-5 Molecular Formula: C8H12S Molecular Weight (g/mol): 140.244 MDL Number: MFCD00022534 InChI Key: MNDZHERKKXUTOE-UHFFFAOYSA-N Synonym: 2-n-butylthiophene,thiophene, 2-butyl,2-n-butyl thiophene,ccris 6900,2-butyl-thiophene,thiophene, butyl,acmc-20c3ak PubChem CID: 73818 IUPAC Name: 2-butylthiophene SMILES: CCCCC1=CC=CS1
| PubChem CID | 73818 |
|---|---|
| CAS | 1455-20-5 |
| Molecular Weight (g/mol) | 140.244 |
| MDL Number | MFCD00022534 |
| SMILES | CCCCC1=CC=CS1 |
| Synonym | 2-n-butylthiophene,thiophene, 2-butyl,2-n-butyl thiophene,ccris 6900,2-butyl-thiophene,thiophene, butyl,acmc-20c3ak |
| IUPAC Name | 2-butylthiophene |
| InChI Key | MNDZHERKKXUTOE-UHFFFAOYSA-N |
| Molecular Formula | C8H12S |
4,5,6,7-Tetrahydrobenzo[b]thiophene, 97%
CAS: 13129-17-4 Molecular Formula: C8H10S Molecular Weight (g/mol): 138.228 MDL Number: MFCD19442759 InChI Key: CBKDCOKSXCTDAA-UHFFFAOYSA-N Synonym: 4,5,6,7-tetrahydrobenzo b thiophene,benzothiophene, 4,5,6,7-tetrahydro,4,5,6,7-tetrahydro-2-benzothiophene,benzo b thiophene, 4,5,6,7-tetrahydro,5-17-01-00498 beilstein handbook reference PubChem CID: 22946 IUPAC Name: 4,5,6,7-tetrahydro-1-benzothiophene SMILES: C1CCC2=C(C1)C=CS2
| PubChem CID | 22946 |
|---|---|
| CAS | 13129-17-4 |
| Molecular Weight (g/mol) | 138.228 |
| MDL Number | MFCD19442759 |
| SMILES | C1CCC2=C(C1)C=CS2 |
| Synonym | 4,5,6,7-tetrahydrobenzo b thiophene,benzothiophene, 4,5,6,7-tetrahydro,4,5,6,7-tetrahydro-2-benzothiophene,benzo b thiophene, 4,5,6,7-tetrahydro,5-17-01-00498 beilstein handbook reference |
| IUPAC Name | 4,5,6,7-tetrahydro-1-benzothiophene |
| InChI Key | CBKDCOKSXCTDAA-UHFFFAOYSA-N |
| Molecular Formula | C8H10S |
2-Amino-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carbonitrile
CAS: 70291-62-2 Molecular Formula: C8H8N2S Molecular Weight (g/mol): 164.23 MDL Number: MFCD00121495 InChI Key: RILAXFOADRDGPQ-UHFFFAOYSA-N PubChem CID: 258182 IUPAC Name: 2-amino-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carbonitrile SMILES: NC1=C(C#N)C2=C(CCC2)S1
| PubChem CID | 258182 |
|---|---|
| CAS | 70291-62-2 |
| Molecular Weight (g/mol) | 164.23 |
| MDL Number | MFCD00121495 |
| SMILES | NC1=C(C#N)C2=C(CCC2)S1 |
| IUPAC Name | 2-amino-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carbonitrile |
| InChI Key | RILAXFOADRDGPQ-UHFFFAOYSA-N |
| Molecular Formula | C8H8N2S |
4-Hydroxyindole, 98%
CAS: 2380-94-1 Molecular Formula: C8H7NO Molecular Weight (g/mol): 133.15 MDL Number: MFCD00005667 InChI Key: NLMQHXUGJIAKTH-UHFFFAOYSA-N Synonym: 4-hydroxyindole,indol-4-ol,4-indolol,hydroxyindole,4-hydroxy-1h-indole,1h-indole-4-ol,4-hydroxy indole,unii-1w4vd9085v,hydroxyindoles,4-hydroxy-indole PubChem CID: 75421 ChEBI: CHEBI:24702 IUPAC Name: 1H-indol-4-ol SMILES: OC1=C2C=CNC2=CC=C1
| PubChem CID | 75421 |
|---|---|
| CAS | 2380-94-1 |
| Molecular Weight (g/mol) | 133.15 |
| ChEBI | CHEBI:24702 |
| MDL Number | MFCD00005667 |
| SMILES | OC1=C2C=CNC2=CC=C1 |
| Synonym | 4-hydroxyindole,indol-4-ol,4-indolol,hydroxyindole,4-hydroxy-1h-indole,1h-indole-4-ol,4-hydroxy indole,unii-1w4vd9085v,hydroxyindoles,4-hydroxy-indole |
| IUPAC Name | 1H-indol-4-ol |
| InChI Key | NLMQHXUGJIAKTH-UHFFFAOYSA-N |
| Molecular Formula | C8H7NO |
2-(2-Pyridyl)benzimidazole, 99%
CAS: 1137-68-4 Molecular Formula: C12H9N3 Molecular Weight (g/mol): 195.23 MDL Number: MFCD00005586 InChI Key: YNFBMDWHEHETJW-UHFFFAOYSA-N Synonym: 2-2-pyridyl benzimidazole,2-pyridin-2-yl-1h-benzo d imidazole,2-pyridin-2-yl-1h-benzoimidazole,2-pyridin-2-yl-1h-1,3-benzodiazole,2-pyridin-2-yl-1h-benzimidazole,chembl72683,1h-benzimidazole, 2-pyridinyl,1h-benzimidazole, 2-2-pyridinyl,acmc-20aime,2 2-pyridyl benzimidazole PubChem CID: 70821 IUPAC Name: 2-pyridin-2-yl-1H-benzimidazole SMILES: N1C2=CC=CC=C2N=C1C1=CC=CC=N1
| PubChem CID | 70821 |
|---|---|
| CAS | 1137-68-4 |
| Molecular Weight (g/mol) | 195.23 |
| MDL Number | MFCD00005586 |
| SMILES | N1C2=CC=CC=C2N=C1C1=CC=CC=N1 |
| Synonym | 2-2-pyridyl benzimidazole,2-pyridin-2-yl-1h-benzo d imidazole,2-pyridin-2-yl-1h-benzoimidazole,2-pyridin-2-yl-1h-1,3-benzodiazole,2-pyridin-2-yl-1h-benzimidazole,chembl72683,1h-benzimidazole, 2-pyridinyl,1h-benzimidazole, 2-2-pyridinyl,acmc-20aime,2 2-pyridyl benzimidazole |
| IUPAC Name | 2-pyridin-2-yl-1H-benzimidazole |
| InChI Key | YNFBMDWHEHETJW-UHFFFAOYSA-N |
| Molecular Formula | C12H9N3 |
3-Thiopheneethanol, 98%, Thermo Scientific Chemicals
CAS: 13781-67-4 Molecular Formula: C6H8OS Molecular Weight (g/mol): 128.19 MDL Number: MFCD00009766 InChI Key: YYPNNBPPDFTQFX-UHFFFAOYSA-N Synonym: 2-thiophen-3-yl ethanol,3-thiopheneethanol,2-3-thienyl ethanol,thiophene-3-ethanol,3-2-hydroxyethyl thiophene,2-thiophen-3-yl ethan-1-ol,2-thien-3-yl ethan-1-ol,3-thiophene-ethanol,pubchem20415 PubChem CID: 83731 IUPAC Name: 2-thiophen-3-ylethanol SMILES: OCCC1=CSC=C1
| PubChem CID | 83731 |
|---|---|
| CAS | 13781-67-4 |
| Molecular Weight (g/mol) | 128.19 |
| MDL Number | MFCD00009766 |
| SMILES | OCCC1=CSC=C1 |
| Synonym | 2-thiophen-3-yl ethanol,3-thiopheneethanol,2-3-thienyl ethanol,thiophene-3-ethanol,3-2-hydroxyethyl thiophene,2-thiophen-3-yl ethan-1-ol,2-thien-3-yl ethan-1-ol,3-thiophene-ethanol,pubchem20415 |
| IUPAC Name | 2-thiophen-3-ylethanol |
| InChI Key | YYPNNBPPDFTQFX-UHFFFAOYSA-N |
| Molecular Formula | C6H8OS |
Bis(pinacolato)diboron, 98+%
CAS: 73183-34-3 Molecular Formula: C12H24B2O4 Molecular Weight (g/mol): 253.94 MDL Number: MFCD00799570 InChI Key: IPWKHHSGDUIRAH-UHFFFAOYSA-N Synonym: bis pinacolato diboron,bis pinacolato diborane,4,4,4',4',5,5,5',5'-octamethyl-2,2'-bi 1,3,2-dioxaborolane,pinacol diborane,diboron pinacol ester,b2pin2,4,4,4',4',5,5,5',5'-octamethyl-2,2'-bi-1,3,2-dioxaborolane,4,4,5,5-tetramethyl-2-tetramethyl-1,3,2-dioxaborolan-2-yl-1,3,2-dioxaborolane,bispinacolate diboron,unii-i906w26p4u PubChem CID: 2733548 IUPAC Name: 4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane SMILES: CC1(C)OB(OC1(C)C)B1OC(C)(C)C(C)(C)O1
| PubChem CID | 2733548 |
|---|---|
| CAS | 73183-34-3 |
| Molecular Weight (g/mol) | 253.94 |
| MDL Number | MFCD00799570 |
| SMILES | CC1(C)OB(OC1(C)C)B1OC(C)(C)C(C)(C)O1 |
| Synonym | bis pinacolato diboron,bis pinacolato diborane,4,4,4',4',5,5,5',5'-octamethyl-2,2'-bi 1,3,2-dioxaborolane,pinacol diborane,diboron pinacol ester,b2pin2,4,4,4',4',5,5,5',5'-octamethyl-2,2'-bi-1,3,2-dioxaborolane,4,4,5,5-tetramethyl-2-tetramethyl-1,3,2-dioxaborolan-2-yl-1,3,2-dioxaborolane,bispinacolate diboron,unii-i906w26p4u |
| IUPAC Name | 4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane |
| InChI Key | IPWKHHSGDUIRAH-UHFFFAOYSA-N |
| Molecular Formula | C12H24B2O4 |
Furan-2-boronic acid, 97%
CAS: 13331-23-2 Molecular Formula: C4H5BO3 Molecular Weight (g/mol): 111.891 MDL Number: MFCD00799544 InChI Key: PZJSZBJLOWMDRG-UHFFFAOYSA-N Synonym: 2-furanboronic acid,furan-2-boronic acid,2-furylboronic acid,2-furanylboronic acid,furan-2-ylboranediol,furan 2-boronic acid,2-furan boronic acid,furan-2-yl boronic acid,boronic acid, furanyl,2furylboronic acid PubChem CID: 2734357 IUPAC Name: furan-2-ylboronic acid SMILES: B(C1=CC=CO1)(O)O
| PubChem CID | 2734357 |
|---|---|
| CAS | 13331-23-2 |
| Molecular Weight (g/mol) | 111.891 |
| MDL Number | MFCD00799544 |
| SMILES | B(C1=CC=CO1)(O)O |
| Synonym | 2-furanboronic acid,furan-2-boronic acid,2-furylboronic acid,2-furanylboronic acid,furan-2-ylboranediol,furan 2-boronic acid,2-furan boronic acid,furan-2-yl boronic acid,boronic acid, furanyl,2furylboronic acid |
| IUPAC Name | furan-2-ylboronic acid |
| InChI Key | PZJSZBJLOWMDRG-UHFFFAOYSA-N |
| Molecular Formula | C4H5BO3 |
3-Methyl-5-phenyl-1H-pyrazole, Thermo Scientific Chemicals
CAS: 3347-62-4 Molecular Formula: C10H10N2 Molecular Weight (g/mol): 158.20 MDL Number: MFCD00022385,MFCD00524752 InChI Key: QHRSESMSOJZMCO-UHFFFAOYSA-N PubChem CID: 18774 IUPAC Name: 5-methyl-3-phenyl-1H-pyrazole SMILES: CC1=CC(=NN1)C1=CC=CC=C1
| PubChem CID | 18774 |
|---|---|
| CAS | 3347-62-4 |
| Molecular Weight (g/mol) | 158.20 |
| MDL Number | MFCD00022385,MFCD00524752 |
| SMILES | CC1=CC(=NN1)C1=CC=CC=C1 |
| IUPAC Name | 5-methyl-3-phenyl-1H-pyrazole |
| InChI Key | QHRSESMSOJZMCO-UHFFFAOYSA-N |
| Molecular Formula | C10H10N2 |
2-Hydroxyquinoxaline, 98%, Thermo Scientific™
CAS: 1196-57-2 Molecular Formula: C8H6N2O Molecular Weight (g/mol): 146.15 MDL Number: MFCD00006722 InChI Key: FFRYUAVNPBUEIC-UHFFFAOYSA-N Synonym: 2-hydroxyquinoxaline,quinoxalin-2-ol,2-quinoxalinol,2 1h-quinoxalinone,quinoxalin-2 1h-one,quinoxalin-2-one,2-quinoxalinone,3-quinoxalinone,2-quinoxalone,1,2-dihydroquinoxalin-2-one PubChem CID: 14526 ChEBI: CHEBI:38890 IUPAC Name: 1H-quinoxalin-2-one SMILES: O=C1NC2=CC=CC=C2N=C1
| PubChem CID | 14526 |
|---|---|
| CAS | 1196-57-2 |
| Molecular Weight (g/mol) | 146.15 |
| ChEBI | CHEBI:38890 |
| MDL Number | MFCD00006722 |
| SMILES | O=C1NC2=CC=CC=C2N=C1 |
| Synonym | 2-hydroxyquinoxaline,quinoxalin-2-ol,2-quinoxalinol,2 1h-quinoxalinone,quinoxalin-2 1h-one,quinoxalin-2-one,2-quinoxalinone,3-quinoxalinone,2-quinoxalone,1,2-dihydroquinoxalin-2-one |
| IUPAC Name | 1H-quinoxalin-2-one |
| InChI Key | FFRYUAVNPBUEIC-UHFFFAOYSA-N |
| Molecular Formula | C8H6N2O |
3-(2-Furyl)acrylic acid, 99%
CAS: 539-47-9 Molecular Formula: C7H6O3 Molecular Weight (g/mol): 138.12 MDL Number: MFCD00003257,MFCD11656544 InChI Key: ZCJLOOJRNPHKAV-ONEGZZNKSA-N Synonym: 3-2-furyl acrylic acid,e-3-furan-2-yl acrylic acid,2-furanacrylic acid,3-furan-2-yl acrylic acid,furanacrylic acid,2-furalacetic acid,furacrylic acid,furylacrylic acid,2e-3-furan-2-yl prop-2-enoic acid,2-propenoic acid, 3-2-furanyl PubChem CID: 643402 SMILES: OC(=O)\C=C\C1=CC=CO1
| PubChem CID | 643402 |
|---|---|
| CAS | 539-47-9 |
| Molecular Weight (g/mol) | 138.12 |
| MDL Number | MFCD00003257,MFCD11656544 |
| SMILES | OC(=O)\C=C\C1=CC=CO1 |
| Synonym | 3-2-furyl acrylic acid,e-3-furan-2-yl acrylic acid,2-furanacrylic acid,3-furan-2-yl acrylic acid,furanacrylic acid,2-furalacetic acid,furacrylic acid,furylacrylic acid,2e-3-furan-2-yl prop-2-enoic acid,2-propenoic acid, 3-2-furanyl |
| InChI Key | ZCJLOOJRNPHKAV-ONEGZZNKSA-N |
| Molecular Formula | C7H6O3 |