7-Fluoro-2,4(1H,3H)-quinazolinedione
7-Fluoro-2,4(1H,3H)-quinazolinedione structure
|
Common Name | 7-Fluoro-2,4(1H,3H)-quinazolinedione | ||
|---|---|---|---|---|
| CAS Number | 76088-98-7 | Molecular Weight | 180.136 | |
| Density | 1.4±0.1 g/cm3 | Boiling Point | 246.1ºC at 760 mmHg | |
| Molecular Formula | C8H5FN2O2 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | 102.6ºC | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 7-Fluoroquinazoline-2,4(1H,3H)-dione |
|---|---|
| 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 | 1.4±0.1 g/cm3 |
|---|---|
| Boiling Point | 246.1ºC at 760 mmHg |
| Molecular Formula | C8H5FN2O2 |
| Molecular Weight | 180.136 |
| Flash Point | 102.6ºC |
| Exact Mass | 180.033508 |
| PSA | 65.72000 |
| LogP | 1.04 |
| Index of Refraction | 1.563 |
| InChIKey | TVXRSUFHSHBLOM-UHFFFAOYSA-N |
| SMILES | O=c1[nH]c(=O)c2ccc(F)cc2[nH]1 |
| Storage condition | 2-8°C |
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| Hazard Codes | Xi |
|---|---|
| HS Code | 2933990090 |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
|
~71%
7-Fluoro-2,4(1H... CAS#:76088-98-7 |
| Literature: Caprathe, Bradley William; Glase, Shelly Ann; Konstantinou, Zissis; Schelkun, Robert Michael; Sheehan, Susan M.; Thomas, Anthony Jerome; Yuen, Po-Wai Patent: US2005/96327 A1, 2005 ; Location in patent: Page/Page column 28 ; US 20050096327 A1 |
|
~63%
7-Fluoro-2,4(1H... CAS#:76088-98-7 |
| Literature: Impact Therapeutics, Inc.; Cai, Sui Xiong; Tian, Ye Edward; Dong, Haijun; Xu, Qingbing; Wu, Lizhen; Liu, Lijun; Jiang, Yangzhen; Bao, Qingli; Wang, Guoxiang; Yin, Feng; Gu, Chengyun; Hu, Xiuhua; Wang, Xiaozhu; Kang, Sishun; Chen, Shengzhi Patent: US2014/23642 A1, 2014 ; Location in patent: Paragraph 0411 ; |
|
~78%
7-Fluoro-2,4(1H... CAS#:76088-98-7 |
| Literature: ASTRAZENECA AB; ASTRAZENECA UK LIMITED Patent: WO2005/49033 A1, 2005 ; Location in patent: Page/Page column 112 ; WO 2005/049033 A1 |
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 3 | |
|---|---|
| DownStream 2 | |
CAS#:174566-15-5
CAS#:1007308-74-8This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2933990090 |
|---|---|
| Summary | 2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0% |
This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| 7-Fluoro-2,4(1H,3H)-quinazolinedione |
| 7-fluoro-1H-quinazoline-2,4-dione |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the polar surface area (PSA) of 7-Fluoroquinazoline-2,4(1H,3H)-dione? |
| A: Polar surface area (PSA) of 7-Fluoroquinazoline-2,4(1H,3H)-dione is 65.72000. |
| Q: What is the molecular weight of 7-Fluoroquinazoline-2,4(1H,3H)-dione? |
| A: Molecular weight of 7-Fluoroquinazoline-2,4(1H,3H)-dione is 180.136. |
| Q: What is the molecular formula of 7-Fluoroquinazoline-2,4(1H,3H)-dione? |
| A: Molecular formula of 7-Fluoroquinazoline-2,4(1H,3H)-dione is C8H5FN2O2. |
| Q: What is the CAS number of 7-Fluoroquinazoline-2,4(1H,3H)-dione? |
| A: CAS number of 7-Fluoroquinazoline-2,4(1H,3H)-dione is 76088-98-7. |
| Q: What is the boiling point of 7-Fluoroquinazoline-2,4(1H,3H)-dione? |
| A: Boiling point of 7-Fluoroquinazoline-2,4(1H,3H)-dione is 246.1ºC at 760 mmHg. |
| Q: What is the SMILES notation of 7-Fluoroquinazoline-2,4(1H,3H)-dione? |
| A: SMILES notation of 7-Fluoroquinazoline-2,4(1H,3H)-dione is O=c1[nH]c(=O)c2ccc(F)cc2[nH]1. |
| Q: What are the storage conditions for 7-Fluoroquinazoline-2,4(1H,3H)-dione? |
| A: Storage conditions for 7-Fluoroquinazoline-2,4(1H,3H)-dione: 2-8°C. |
| Q: What is the LogP of 7-Fluoroquinazoline-2,4(1H,3H)-dione? |
| A: LogP of 7-Fluoroquinazoline-2,4(1H,3H)-dione is 1.04. |
| Q: What are the upstream materials of 7-Fluoroquinazoline-2,4(1H,3H)-dione? |
| A: Related upstream materials(CAS) of 7-Fluoroquinazoline-2,4(1H,3H)-dione: 446-32-2;590-28-3;57-13-6. |
| Q: What English synonyms does 7-Fluoroquinazoline-2,4(1H,3H)-dione have? |
| A: English synonyms of 7-Fluoroquinazoline-2,4(1H,3H)-dione: 7-Fluoro-2,4(1H,3H)-quinazolinedione, 7-fluoro-1H-quinazoline-2,4-dione. |
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. |