1-Chloro-6-fluoroisoquinoline
1-Chloro-6-fluoroisoquinoline structure
|
Common Name | 1-Chloro-6-fluoroisoquinoline | ||
|---|---|---|---|---|
| CAS Number | 214045-86-0 | Molecular Weight | 181.59400 | |
| Density | N/A | Boiling Point | 295.6±20.0°C at 760 mmHg | |
| Molecular Formula | C9H5ClFN | Melting Point | N/A | |
| MSDS | N/A | Flash Point | N/A | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 1-Chloro-6-fluoroisoquinoline |
|---|---|
| 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.
| Boiling Point | 295.6±20.0°C at 760 mmHg |
|---|---|
| Molecular Formula | C9H5ClFN |
| Molecular Weight | 181.59400 |
| Exact Mass | 181.00900 |
| PSA | 12.89000 |
| LogP | 3.02730 |
| InChIKey | QZBWBBHQRLUOTM-UHFFFAOYSA-N |
| SMILES | Fc1ccc2c(Cl)nccc2c1 |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
|
~75%
1-Chloro-6-fluo... CAS#:214045-86-0 |
| Literature: NOVARTIS AG; NOVARTIS PHARMA GMBH Patent: WO2005/28444 A1, 2005 ; Location in patent: Page/Page column 47-48; 69-70 ; WO 2005/028444 A1 |
|
~43%
1-Chloro-6-fluo... CAS#:214045-86-0 |
| Literature: BRISTOL-MYERS SQUIBB COMPANY Patent: WO2003/99274 A1, 2003 ; Location in patent: Page 271-272 ; WO 03/099274 A1 |
|
~29%
1-Chloro-6-fluo... CAS#:214045-86-0 |
| Literature: Ting, Hao-Chun; Chen, You-Ming; You, Hong-Wei; Hung, Wen-Yi; Lin, Sheng-Hsun; Chaskar, Atul; Chou, Shu-Hua; Chi, Yun; Liu, Rai-Hsung; Wong, Ken-Tsung Journal of Materials Chemistry, 2012 , vol. 22, # 17 p. 8399 - 8407 |
This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| Isoquinoline,1-chloro-6-fluoro |
| Y5343 |
| 1-chloro-6-fluoro-isoquinoline |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the InChIKey of 1-Chloro-6-fluoroisoquinoline? |
| A: InChIKey of 1-Chloro-6-fluoroisoquinoline is QZBWBBHQRLUOTM-UHFFFAOYSA-N. |
| Q: What is the LogP of 1-Chloro-6-fluoroisoquinoline? |
| A: LogP of 1-Chloro-6-fluoroisoquinoline is 3.02730. |
| Q: What is the polar surface area (PSA) of 1-Chloro-6-fluoroisoquinoline? |
| A: Polar surface area (PSA) of 1-Chloro-6-fluoroisoquinoline is 12.89000. |
| Q: What is the CAS number of 1-Chloro-6-fluoroisoquinoline? |
| A: CAS number of 1-Chloro-6-fluoroisoquinoline is 214045-86-0. |
| Q: What is the SMILES notation of 1-Chloro-6-fluoroisoquinoline? |
| A: SMILES notation of 1-Chloro-6-fluoroisoquinoline is Fc1ccc2c(Cl)nccc2c1. |
| Q: What is the English name of 1-Chloro-6-fluoroisoquinoline? |
| A: The English name of 1-Chloro-6-fluoroisoquinoline is 1-Chloro-6-fluoroisoquinoline. |
| Q: What is the boiling point of 1-Chloro-6-fluoroisoquinoline? |
| A: Boiling point of 1-Chloro-6-fluoroisoquinoline is 295.6±20.0°C at 760 mmHg. |
| Q: What English synonyms does 1-Chloro-6-fluoroisoquinoline have? |
| A: English synonyms of 1-Chloro-6-fluoroisoquinoline: Isoquinoline,1-chloro-6-fluoro, Y5343, 1-chloro-6-fluoro-isoquinoline. |
| Q: What is the molecular formula of 1-Chloro-6-fluoroisoquinoline? |
| A: Molecular formula of 1-Chloro-6-fluoroisoquinoline is C9H5ClFN. |
| Q: What is the molecular weight of 1-Chloro-6-fluoroisoquinoline? |
| A: Molecular weight of 1-Chloro-6-fluoroisoquinoline is 181.59400. |
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. |