6-PHENOXYNICOTINONITRILE
6-PHENOXYNICOTINONITRILE structure
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Common Name | 6-PHENOXYNICOTINONITRILE | ||
|---|---|---|---|---|
| CAS Number | 99902-72-4 | Molecular Weight | 196.20500 | |
| Density | 1.23g/cm3 | Boiling Point | 340.8ºC at 760 mmHg | |
| Molecular Formula | C12H8N2O | Melting Point | N/A | |
| MSDS | N/A | Flash Point | 159.9ºC | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 6-phenoxypyridine-3-carbonitrile |
|---|---|
| Synonym | More Synonyms |
This table shows physicochemical parameters including melting point, boiling point, density, solubility and optical rotation. Missing data is marked as N/A.
| Density | 1.23g/cm3 |
|---|---|
| Boiling Point | 340.8ºC at 760 mmHg |
| Molecular Formula | C12H8N2O |
| Molecular Weight | 196.20500 |
| Flash Point | 159.9ºC |
| Exact Mass | 196.06400 |
| PSA | 45.91000 |
| LogP | 2.74558 |
| Index of Refraction | 1.613 |
| InChIKey | FBFTWRLLJHLPNJ-UHFFFAOYSA-N |
| SMILES | N#Cc1ccc(Oc2ccccc2)nc1 |
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| HS Code | 2933399090 |
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This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
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~89%
6-PHENOXYNICOTI... CAS#:99902-72-4 |
| Literature: Takeda Pharmaceutical Company Limited Patent: EP1500658 A1, 2005 ; Location in patent: Page 50 ; EP 1500658 A1 |
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~82%
6-PHENOXYNICOTI... CAS#:99902-72-4 |
| Literature: Zhu, Yongbao; Cameron, Beth R.; Skerlj, Renato T. Journal of Organometallic Chemistry, 2003 , vol. 677, # 1-2 p. 57 - 72 |
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~%
6-PHENOXYNICOTI... CAS#:99902-72-4 |
| Literature: Journal of Organometallic Chemistry, , vol. 677, # 1-2 p. 57 - 72 |
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~%
6-PHENOXYNICOTI... CAS#:99902-72-4 |
| Literature: Journal of Organometallic Chemistry, , vol. 677, # 1-2 p. 57 - 72 |
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 5 | |
|---|---|
| DownStream 1 | |
CAS#:51362-38-0This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2933399090 |
|---|---|
| Summary | 2933399090. other compounds containing an unfused pyridine ring (whether or not hydrogenated) in the structure. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0% |
This table contains target information, in‑vitro & in‑vivo assay data for this compound.
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Name: Discovery of Small Molecules to Inhibit Human Cytomegalovirus Nuclear Egress
Source: ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
Target: HCMV UL50
External Id: HMS1262
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Name: Ratio of the MIC50 of 6-(4-Nitro-phenoxy)-nicotinonitrile compared to compound obtain...
Source: ChEMBL
Target: Enterovirus
External Id: CHEMBL800918
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Name: Lowest concentration to reduce viral effect by 50% or more against Rhinovirus (RV)-1A
Source: ChEMBL
Target: Enterovirus
External Id: CHEMBL800917
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Name: Ratio of the MIC50 of 6-(4-Nitro-phenoxy)-nicotinonitrile compared to compound obtain...
Source: ChEMBL
Target: Coxsackievirus
External Id: CHEMBL661536
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Name: Cytotoxicity concentration in HeLa cells
Source: ChEMBL
Target: HeLa
External Id: CHEMBL641837
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Name: Lowest concentration to reduce viral effect by 50% or more against coxsackie virus A2...
Source: ChEMBL
Target: Coxsackievirus
External Id: CHEMBL665061
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Name: High-throughput screen for inhibitors of the GIV GBA-motif interaction with Galpha-i ...
Source: ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
External Id: HMS1303
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Name: A screen for compounds that inhibit the activity of LtaS in Staphylococcus aureus
Source: ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
External Id: HMS979
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This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| 5-cyano-2-phenoxypyridine |
| 6-phenoxynicotinonitrile |
| 6-PHENOXY-3-PYRIDINECARBONITRILE |
| 3-Pyridinecarbonitrile,6-phenoxy |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the molecular formula of 6-phenoxypyridine-3-carbonitrile? |
| A: Molecular formula of 6-phenoxypyridine-3-carbonitrile is C12H8N2O. |
| Q: What is the boiling point of 6-phenoxypyridine-3-carbonitrile? |
| A: Boiling point of 6-phenoxypyridine-3-carbonitrile is 340.8ºC at 760 mmHg. |
| Q: What is the polar surface area (PSA) of 6-phenoxypyridine-3-carbonitrile? |
| A: Polar surface area (PSA) of 6-phenoxypyridine-3-carbonitrile is 45.91000. |
| Q: What is the molecular weight of 6-phenoxypyridine-3-carbonitrile? |
| A: Molecular weight of 6-phenoxypyridine-3-carbonitrile is 196.20500. |
| Q: What is the English name of 6-phenoxypyridine-3-carbonitrile? |
| A: The English name of 6-phenoxypyridine-3-carbonitrile is 6-phenoxypyridine-3-carbonitrile. |
| Q: What is the CAS number of 6-phenoxypyridine-3-carbonitrile? |
| A: CAS number of 6-phenoxypyridine-3-carbonitrile is 99902-72-4. |
| Q: What is the InChIKey of 6-phenoxypyridine-3-carbonitrile? |
| A: InChIKey of 6-phenoxypyridine-3-carbonitrile is FBFTWRLLJHLPNJ-UHFFFAOYSA-N. |
| Q: What English synonyms does 6-phenoxypyridine-3-carbonitrile have? |
| A: English synonyms of 6-phenoxypyridine-3-carbonitrile: 5-cyano-2-phenoxypyridine, 6-phenoxynicotinonitrile, 6-PHENOXY-3-PYRIDINECARBONITRILE, 3-Pyridinecarbonitrile,6-phenoxy. |
| Q: What are the downstream products of 6-phenoxypyridine-3-carbonitrile? |
| A: Related downstream products(CAS) of 6-phenoxypyridine-3-carbonitrile: 51362-38-0. |
| Q: What is the LogP of 6-phenoxypyridine-3-carbonitrile? |
| A: LogP of 6-phenoxypyridine-3-carbonitrile is 2.74558. |
This table lists manufacturers and suppliers of this compound, including vendor names and product supply reference information.
| Shanghai Nianxing Industrial Co., Ltd |
| Dayang Chem (Hangzhou) Co., Ltd. |