1-phenyl-3-(trifluoromethyl)-2-pyrazolin-5-one
1-phenyl-3-(trifluoromethyl)-2-pyrazolin-5-one structure
|
Common Name | 1-phenyl-3-(trifluoromethyl)-2-pyrazolin-5-one | ||
|---|---|---|---|---|
| CAS Number | 321-07-3 | Molecular Weight | 228.17100 | |
| Density | 1.39g/cm3 | Boiling Point | 278.7ºC at 760mmHg | |
| Molecular Formula | C10H7F3N2O | Melting Point | 195-196°C | |
| MSDS | USA | Flash Point | 122.3ºC | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 2-phenyl-5-(trifluoromethyl)-4H-pyrazol-3-one |
|---|---|
| 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 | 1.39g/cm3 |
|---|---|
| Boiling Point | 278.7ºC at 760mmHg |
| Melting Point | 195-196°C |
| Molecular Formula | C10H7F3N2O |
| Molecular Weight | 228.17100 |
| Flash Point | 122.3ºC |
| Exact Mass | 228.05100 |
| PSA | 32.67000 |
| LogP | 1.84220 |
| Index of Refraction | 1.543 |
| InChIKey | GLGRRRKQSFURGD-UHFFFAOYSA-N |
| SMILES | O=C1CC(C(F)(F)F)=NN1c1ccccc1 |
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| Hazard Codes | Xi: Irritant; |
|---|---|
| Risk Phrases | R36/37/38 |
| Safety Phrases | S26-S36 |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
|
~96%
1-phenyl-3-(tri... CAS#:321-07-3 |
| Literature: Indian Journal of Chemistry - Section B Organic and Medicinal Chemistry, , vol. 45, # 5 p. 1315 - 1318 |
|
~85%
1-phenyl-3-(tri... CAS#:321-07-3 |
| Literature: Tetrahedron, , vol. 65, # 13 p. 2660 - 2668 |
This table contains target information, in‑vitro & in‑vivo assay data for this compound.
|
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
|
|
Name: Screen for inhibitors of RMI FANCM (MM2) intereaction
Source: 11908
Target: N/A
External Id: RMI-FANCM-MM2
|
|
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
|
|
Name: Antiprion activity in ScN2a cells assessed as inhibition of protease-resistant prion ...
Source: ChEMBL
Target: ScN2a
External Id: CHEMBL894352
|
|
Name: A screen for compounds that inhibit viral RNA polymerase binding and polymerization a...
Source: ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
Target: Chain A, Poliovirus Polymerase With Gtp
External Id: HMS750
|
|
Name: Cytotoxicity against human NB69 cells by MTT assay
Source: ChEMBL
Target: NB69
External Id: CHEMBL895428
|
|
Name: Cytotoxicity against mouse ScN2a cells by MTT assay
Source: ChEMBL
Target: ScN2a
External Id: CHEMBL895429
|
|
Name: Cytotoxicity against mouse F3 cells by MTT assay
Source: ChEMBL
Target: N/A
External Id: CHEMBL895430
|
|
Name: Antiprion activity in F3 cells assessed as inhibition of protease-resistant prion pro...
Source: ChEMBL
Target: NON-PROTEIN TARGET
External Id: CHEMBL894353
|
|
Name: Dicer-mediated maturation of pre-microRNA
Source: Center for Chemical Genomics, University of Michigan
Target: N/A
External Id: TargetID_659_CEMA
|
This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| 1-phenyl-3-trifluoromethyl-5-pyrazolone |
| 3-trifluoromethyl-1-phenyl-2-pyrazolin-5-one |
| 3-triuoromethyl-1-phenyl-2-pyrazolin-5-one |
| 1-Phenyl-3-trifluoromethyl-2-pyrazolin-5-one |
| MFCD00051655 |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the CAS number of 2-phenyl-5-(trifluoromethyl)-4H-pyrazol-3-one? |
| A: CAS number of 2-phenyl-5-(trifluoromethyl)-4H-pyrazol-3-one is 321-07-3. |
| Q: What is the melting point of 2-phenyl-5-(trifluoromethyl)-4H-pyrazol-3-one? |
| A: Melting point of 2-phenyl-5-(trifluoromethyl)-4H-pyrazol-3-one is 195-196°C. |
| Q: What is the InChIKey of 2-phenyl-5-(trifluoromethyl)-4H-pyrazol-3-one? |
| A: InChIKey of 2-phenyl-5-(trifluoromethyl)-4H-pyrazol-3-one is GLGRRRKQSFURGD-UHFFFAOYSA-N. |
| Q: What is the molecular formula of 2-phenyl-5-(trifluoromethyl)-4H-pyrazol-3-one? |
| A: Molecular formula of 2-phenyl-5-(trifluoromethyl)-4H-pyrazol-3-one is C10H7F3N2O. |
| Q: What is the English name of 2-phenyl-5-(trifluoromethyl)-4H-pyrazol-3-one? |
| A: The English name of 2-phenyl-5-(trifluoromethyl)-4H-pyrazol-3-one is 2-phenyl-5-(trifluoromethyl)-4H-pyrazol-3-one. |
| Q: What English synonyms does 2-phenyl-5-(trifluoromethyl)-4H-pyrazol-3-one have? |
| A: English synonyms of 2-phenyl-5-(trifluoromethyl)-4H-pyrazol-3-one: 1-phenyl-3-trifluoromethyl-5-pyrazolone, 3-trifluoromethyl-1-phenyl-2-pyrazolin-5-one, 3-triuoromethyl-1-phenyl-2-pyrazolin-5-one, 1-Phenyl-3-trifluoromethyl-2-pyrazolin-5-one, MFCD00051655. |
| Q: What is the SMILES notation of 2-phenyl-5-(trifluoromethyl)-4H-pyrazol-3-one? |
| A: SMILES notation of 2-phenyl-5-(trifluoromethyl)-4H-pyrazol-3-one is O=C1CC(C(F)(F)F)=NN1c1ccccc1. |
| Q: What is the LogP of 2-phenyl-5-(trifluoromethyl)-4H-pyrazol-3-one? |
| A: LogP of 2-phenyl-5-(trifluoromethyl)-4H-pyrazol-3-one is 1.84220. |
| Q: What is the boiling point of 2-phenyl-5-(trifluoromethyl)-4H-pyrazol-3-one? |
| A: Boiling point of 2-phenyl-5-(trifluoromethyl)-4H-pyrazol-3-one is 278.7ºC at 760mmHg. |
| Q: What is the molecular weight of 2-phenyl-5-(trifluoromethyl)-4H-pyrazol-3-one? |
| A: Molecular weight of 2-phenyl-5-(trifluoromethyl)-4H-pyrazol-3-one is 228.17100. |
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. |