5-Fluoroquinoline
5-Fluoroquinoline structure
|
Common Name | 5-Fluoroquinoline | ||
|---|---|---|---|---|
| CAS Number | 394-69-4 | Molecular Weight | 147.149 | |
| Density | 1.2±0.1 g/cm3 | Boiling Point | 238.4±13.0 °C at 760 mmHg | |
| Molecular Formula | C9H6FN | Melting Point | N/A | |
| MSDS | N/A | Flash Point | 98.0±19.8 °C | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 5-fluoroquinoline |
|---|---|
| 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 | 1.2±0.1 g/cm3 |
|---|---|
| Boiling Point | 238.4±13.0 °C at 760 mmHg |
| Molecular Formula | C9H6FN |
| Molecular Weight | 147.149 |
| Flash Point | 98.0±19.8 °C |
| Exact Mass | 147.048431 |
| PSA | 12.89000 |
| LogP | 2.28 |
| Vapour Pressure | 0.1±0.5 mmHg at 25°C |
| Index of Refraction | 1.614 |
| InChIKey | WMFXCDGQRHJFKL-UHFFFAOYSA-N |
| SMILES | Fc1cccc2ncccc12 |
This table summarizes toxicological test data, acute & chronic toxicity and ecological hazard parameters for this chemical.
CHEMICAL IDENTIFICATION
HEALTH HAZARD DATAACUTE TOXICITY DATAMUTATION DATA
|
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| HS Code | 2933499090 |
|---|
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
|
~53%
5-Fluoroquinoline CAS#:394-69-4 |
| Literature: Al-Awar, Rima Salim; Hecker, Kyle Andrew; Ray, James Edward; Huang, Jianping; Joseph, Sajan; Li, Tiechao; Paal, Michael; Rathnachalam, Radhakrishnan; Shih, Chuan; Waid, Philip Parker; Zhou, Xun; Zhu, Guoxin Patent: US2003/229026 A1, 2003 ; Location in patent: Page 25 ; US 20030229026 A1 |
|
~84%
5-Fluoroquinoline CAS#:394-69-4 |
| Literature: Lee, Hong Geun; Milner, Phillip J.; Buchwald, Stephen L. Journal of the American Chemical Society, 2014 , vol. 136, # 10 p. 3792 - 3795 |
|
~77%
5-Fluoroquinoline CAS#:394-69-4 |
| Literature: Watson, Donald A.; Su, Mingjuan; Teverovskiy, Georgiy; Zhang, Yong; Garcia-Fortanet, Jorge; Kinzel, Tom; Buchwaldf, Stephen L. Science, 2009 , vol. 325, # 5948 p. 1661 - 1664 |
|
~27%
5-Fluoroquinoline CAS#:394-69-4
Detail
Learn More
|
| Literature: Chambers, Richard D; Holling, Darren; Sandford, Graham; Puschmann, Horst; Howard, Judith A.K Journal of Fluorine Chemistry, 2002 , vol. 117, # 2 p. 99 - 101 |
|
~%
5-Fluoroquinoline CAS#:394-69-4 |
| Literature: Van Den Berg, Otto; Jager, Wolter F.; Picken, Stephen J. Journal of Organic Chemistry, 2006 , vol. 71, # 7 p. 2666 - 2676 |
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 6 | |
|---|---|
| DownStream 3 | |
CAS#:152167-85-6
CAS#:161038-18-2
CAS#:455955-27-8This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2933499090 |
|---|---|
| Summary | 2933499090. other compounds containing in the structure a quinoline or isoquinoline ring-system (whether or not hydrogenated), not further fused. 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.
|
Name: Dissociation constant, pKa of the compound
Source: ChEMBL
Target: N/A
External Id: CHEMBL991844
|
This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| 5-Fluoro-quinolinium |
| Quinoline,5-fluoro |
| 5-Fluoroquinoline |
| 5-Fluoro-quinoline |
| 5-Fluor-chinolin |
| 5-Fluoro-1-azanaphthalene |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the SMILES notation of 5-fluoroquinoline? |
| A: SMILES notation of 5-fluoroquinoline is Fc1cccc2ncccc12. |
| Q: What are the upstream materials of 5-fluoroquinoline? |
| A: Related upstream materials(CAS) of 5-fluoroquinoline: 611-34-7;4964-71-0;177734-78-0;91-22-5;372-19-0;56-81-5. |
| Q: What is the molecular weight of 5-fluoroquinoline? |
| A: Molecular weight of 5-fluoroquinoline is 147.149. |
| Q: What is the LogP of 5-fluoroquinoline? |
| A: LogP of 5-fluoroquinoline is 2.28. |
| Q: What is the molecular formula of 5-fluoroquinoline? |
| A: Molecular formula of 5-fluoroquinoline is C9H6FN. |
| Q: What English synonyms does 5-fluoroquinoline have? |
| A: English synonyms of 5-fluoroquinoline: 5-Fluoro-quinolinium, Quinoline,5-fluoro, 5-Fluoroquinoline, 5-Fluoro-quinoline, 5-Fluor-chinolin, 5-Fluoro-1-azanaphthalene. |
| Q: What is the English name of 5-fluoroquinoline? |
| A: The English name of 5-fluoroquinoline is 5-fluoroquinoline. |
| Q: What is the CAS number of 5-fluoroquinoline? |
| A: CAS number of 5-fluoroquinoline is 394-69-4. |
| Q: What are the downstream products of 5-fluoroquinoline? |
| A: Related downstream products(CAS) of 5-fluoroquinoline: 152167-85-6;161038-18-2;455955-27-8. |
| Q: What is the boiling point of 5-fluoroquinoline? |
| A: Boiling point of 5-fluoroquinoline is 238.4±13.0 °C at 760 mmHg. |
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. |