(2-Fluoro-4-biphenyl)acetic Acid
(2-Fluoro-4-biphenyl)acetic Acid structure
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Common Name | (2-Fluoro-4-biphenyl)acetic Acid | ||
|---|---|---|---|---|
| CAS Number | 5001-96-7 | Molecular Weight | 230.23400 | |
| Density | 1.235g/cm3 | Boiling Point | 375.695ºC at 760 mmHg | |
| Molecular Formula | C14H11FO2 | Melting Point | 140-142°C | |
| MSDS | N/A | Flash Point | 181.014ºC | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 2-(3-fluoro-4-phenylphenyl)acetic acid |
|---|---|
| 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 | 1.235g/cm3 |
|---|---|
| Boiling Point | 375.695ºC at 760 mmHg |
| Melting Point | 140-142°C |
| Molecular Formula | C14H11FO2 |
| Molecular Weight | 230.23400 |
| Flash Point | 181.014ºC |
| Exact Mass | 230.07400 |
| PSA | 37.30000 |
| LogP | 3.11980 |
| Index of Refraction | 1.579 |
| InChIKey | ZLLZRKQQNGBXRD-UHFFFAOYSA-N |
| SMILES | O=C(O)Cc1ccc(-c2ccccc2)c(F)c1 |
| Storage condition | -20°C Freezer |
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| Hazard Codes | Xi |
|---|---|
| HS Code | 2916399090 |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
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(2-Fluoro-4-bip... CAS#:5001-96-7 |
| Literature: VANDERBILT UNIVERSITY; MARNETT, Lawrence, J.; PATEL, Sachin; HERMANSON, Daniel, J.; WINDSOR, Matthew, A. Patent: WO2014/15341 A2, 2014 ; Location in patent: Page/Page column 57; 59 ; |
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(2-Fluoro-4-bip... CAS#:5001-96-7 |
| Literature: VANDERBILT UNIVERSITY; MARNETT, Lawrence, J.; PATEL, Sachin; HERMANSON, Daniel, J.; WINDSOR, Matthew, A. Patent: WO2014/15341 A2, 2014 ; |
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(2-Fluoro-4-bip... CAS#:5001-96-7 |
| Literature: Sozio, Piera; Marinelli, Lisa; Cacciatore, Ivana; Fontana, Antonella; Tuerkez, Hasan; Giorgioni, Gianfabio; Ambrosini, Dario; Barbato, Francesco; Grumetto, Lucia; Pacella, Stephanie; Cataldi, Amelia; Di Stefano, Antonio Molecules, 2013 , vol. 18, # 9 p. 10747 - 10767 |
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(2-Fluoro-4-bip... CAS#:5001-96-7 |
| Literature: Schlosser, Manfred; Geneste, Herve Chemistry - A European Journal, 1998 , vol. 4, # 10 p. 1969 - 1973 |
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(2-Fluoro-4-bip... CAS#:5001-96-7 |
| Literature: Schlosser, Manfred; Geneste, Herve Chemistry - A European Journal, 1998 , vol. 4, # 10 p. 1969 - 1973 |
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(2-Fluoro-4-bip... CAS#:5001-96-7 |
| Literature: Schiefer, Isaac T.; Abdul-Hay, Samer; Wang, Huali; Vanni, Michael; Qin, Zhihui; Thatcher, Gregory R. J. Journal of Medicinal Chemistry, 2011 , vol. 54, # 7 p. 2293 - 2306 |
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(2-Fluoro-4-bip... CAS#:5001-96-7 |
| Literature: Schiefer, Isaac T.; Abdul-Hay, Samer; Wang, Huali; Vanni, Michael; Qin, Zhihui; Thatcher, Gregory R. J. Journal of Medicinal Chemistry, 2011 , vol. 54, # 7 p. 2293 - 2306 |
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(2-Fluoro-4-bip... CAS#:5001-96-7 |
| Literature: Schiefer, Isaac T.; Abdul-Hay, Samer; Wang, Huali; Vanni, Michael; Qin, Zhihui; Thatcher, Gregory R. J. Journal of Medicinal Chemistry, 2011 , vol. 54, # 7 p. 2293 - 2306 |
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(2-Fluoro-4-bip... CAS#:5001-96-7 |
| Literature: Schlosser, Manfred; Geneste, Herve Chemistry - A European Journal, 1998 , vol. 4, # 10 p. 1969 - 1973 |
![2--(2--fluoro--[1,1'--biphenyl]--4--yl)acetaldehyde structure](https://image.chemsrc.com/caspic/213/1393566-55-6.png)
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 10 | |
|---|---|
| DownStream 1 | |
CAS#:5104-49-4This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2916399090 |
|---|---|
| Summary | 2916399090 other aromatic monocarboxylic acids, their anhydrides, halides, peroxides, peroxyacids and their derivatives VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0% |
This table contains target information, in‑vitro & in‑vivo assay data for this compound.
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Name: Inhibition of mouse COX2-mediated arachidonic acid oxygenation at 10 uM preincubated ...
Source: ChEMBL
Target: Prostaglandin G/H synthase 2
External Id: CHEMBL2155293
|
|
Name: Inhibition of COX2-mediated arachidonic acid oxygenation in LPS/IFN-gamma-stimulated ...
Source: ChEMBL
Target: Prostaglandin G/H synthase 2
External Id: CHEMBL2155295
|
This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| Desmethylflurbiprofen |
| 2-Fluor-4-biphenylylessigsaeure |
| 2-Fluoro-4-biphenylacetic Acid |
| 3-Fluorbiphenylessigsaeure |
| (2-Fluoro-4-biphenyl)acetic Acid |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What English synonyms does 2-(3-fluoro-4-phenylphenyl)acetic acid have? |
| A: English synonyms of 2-(3-fluoro-4-phenylphenyl)acetic acid: Desmethylflurbiprofen, 2-Fluor-4-biphenylylessigsaeure, 2-Fluoro-4-biphenylacetic Acid, 3-Fluorbiphenylessigsaeure, (2-Fluoro-4-biphenyl)acetic Acid. |
| Q: What is the InChIKey of 2-(3-fluoro-4-phenylphenyl)acetic acid? |
| A: InChIKey of 2-(3-fluoro-4-phenylphenyl)acetic acid is ZLLZRKQQNGBXRD-UHFFFAOYSA-N. |
| Q: What is the CAS number of 2-(3-fluoro-4-phenylphenyl)acetic acid? |
| A: CAS number of 2-(3-fluoro-4-phenylphenyl)acetic acid is 5001-96-7. |
| Q: What is the molecular formula of 2-(3-fluoro-4-phenylphenyl)acetic acid? |
| A: Molecular formula of 2-(3-fluoro-4-phenylphenyl)acetic acid is C14H11FO2. |
| Q: What are the storage conditions for 2-(3-fluoro-4-phenylphenyl)acetic acid? |
| A: Storage conditions for 2-(3-fluoro-4-phenylphenyl)acetic acid: -20°C Freezer. |
| Q: What is the melting point of 2-(3-fluoro-4-phenylphenyl)acetic acid? |
| A: Melting point of 2-(3-fluoro-4-phenylphenyl)acetic acid is 140-142°C. |
| Q: What is the polar surface area (PSA) of 2-(3-fluoro-4-phenylphenyl)acetic acid? |
| A: Polar surface area (PSA) of 2-(3-fluoro-4-phenylphenyl)acetic acid is 37.30000. |
| Q: What are the downstream products of 2-(3-fluoro-4-phenylphenyl)acetic acid? |
| A: Related downstream products(CAS) of 2-(3-fluoro-4-phenylphenyl)acetic acid: 5104-49-4. |
| Q: What is the English name of 2-(3-fluoro-4-phenylphenyl)acetic acid? |
| A: The English name of 2-(3-fluoro-4-phenylphenyl)acetic acid is 2-(3-fluoro-4-phenylphenyl)acetic acid. |
| Q: What is the SMILES notation of 2-(3-fluoro-4-phenylphenyl)acetic acid? |
| A: SMILES notation of 2-(3-fluoro-4-phenylphenyl)acetic acid is O=C(O)Cc1ccc(-c2ccccc2)c(F)c1. |
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. |