2-HYDROXY-3-(TRIFLUOROMETHYL)QUINOXALIN
2-HYDROXY-3-(TRIFLUOROMETHYL)QUINOXALIN structure
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Common Name | 2-HYDROXY-3-(TRIFLUOROMETHYL)QUINOXALIN | ||
|---|---|---|---|---|
| CAS Number | 58457-64-0 | Molecular Weight | 214.14400 | |
| Density | 1.51g/cm3 | Boiling Point | N/A | |
| Molecular Formula | C9H5F3N2O | 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 | 3-(trifluoromethyl)-1H-quinoxalin-2-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 | 1.51g/cm3 |
|---|---|
| Molecular Formula | C9H5F3N2O |
| Molecular Weight | 214.14400 |
| Exact Mass | 214.03500 |
| PSA | 46.01000 |
| LogP | 2.35420 |
| Index of Refraction | 1.565 |
| InChIKey | NOGLKXWLUDJZDQ-UHFFFAOYSA-N |
| SMILES | O=c1[nH]c2ccccc2nc1C(F)(F)F |
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| HS Code | 2933990090 |
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This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
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~83%
2-HYDROXY-3-(TR... CAS#:58457-64-0 |
| Literature: Murthy, Sabbavarapu Narayana; Madhav, Bandaru; Nageswar, Yadavalli Venkata Durga Helvetica Chimica Acta, 2010 , vol. 93, # 6 p. 1216 - 1220 |
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~%
2-HYDROXY-3-(TR... CAS#:58457-64-0 |
| Literature: Bioorganic and Medicinal Chemistry Letters, , vol. 10, # 15 p. 1729 - 1731 |
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~96%
2-HYDROXY-3-(TR... CAS#:58457-64-0 |
| Literature: Mustafa, Mohamed El-Said; Takaoka, Akio; Ishikawa, Nobuo Bulletin de la Societe Chimique de France, 1986 , # 6 p. 944 - 954 |
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~%
2-HYDROXY-3-(TR... CAS#:58457-64-0 |
| Literature: Tyutin, V. Y.; Chkanikov, N. D.; Kolomietz, A. F.; Fokin, A. V. Journal of Fluorine Chemistry, 1991 , vol. 51, # 3 p. 323 - 334 |
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~%
2-HYDROXY-3-(TR... CAS#:58457-64-0 |
| Literature: Journal of Medicinal Chemistry, , vol. 51, # 8 p. 2457 - 2467 |
This 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 contains target information, in‑vitro & in‑vivo assay data for this compound.
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Name: Primary cell-based high-throughput screening assay for identification of compounds th...
Source: Johns Hopkins Ion Channel Center
Target: regulator of G-protein signaling 4 isoform 2 [Homo sapiens]
External Id: JHICC_RGS_Act_HTS
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Name: Luminescence-based cell-based primary high throughput screening assay to identify ago...
Source: The Scripps Research Institute Molecular Screening Center
Target: mu-type opioid receptor isoform MOR-1 [Homo sapiens]
External Id: OPRM1-OPRD1_AG_LUMI_1536_1X%ACT PRUN
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Name: QFRET-based biochemical primary high throughput screening assay to identify exosite i...
Source: The Scripps Research Institute Molecular Screening Center
Target: disintegrin and metalloproteinase domain-containing protein 17 preproprotein [Homo sapiens]
External Id: ADAM17_INH_QFRET_1536_1X%INH PRUN
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Name: Fluorescence-based cell-based primary high throughput screening assay to identify ago...
Source: The Scripps Research Institute Molecular Screening Center
Target: muscarinic acetylcholine receptor M1 [Homo sapiens]
External Id: CHRM1_AG_FLUO8_1536_1X%ACT PRUN
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Name: uHTS identification of small molecule activators of the adaptive arm of the Unfolded ...
Source: Burnham Center for Chemical Genomics
Target: N/A
External Id: BCCG-A405-UPR-XBP1-PrimaryAgonist-Assay
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Name: High throughput fluorescence intensity-based biochemical assay to screen for small mo...
Source: University of Pittsburgh Molecular Library Screening Center
Target: furin (paired basic amino acid cleaving enzyme), isoform CRA_a [Homo sapiens]
External Id: MH080376 Biochemical HTS for Inhibitors of the Proprotein Convertase Furin.
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Name: Fluorescence polarization to screen for inhibitor that competite the binding of FadD2...
Source: Broad Institute
Target: FATTY-ACID-CoA LIGASE FADD28 (FATTY-ACID-CoA SYNTHETASE)
External Id: 2147-01_Inhibitor_SinglePoint_HTS_Activity
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Name: Bursicon-induced LGR2 mediated cAMP production in LGR-2/CRE6x-Luciferase co-transfect...
Source: Broad Institute
Target: N/A
External Id: Bursicon-induced LGR2 mediated cAMP production in LGR-2/CRE6x-Luciferase co-transfected HEK293 cells Inhibition - 7011-01_Antagonist_SinglePoint_HTS_Activity
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Name: Primary Screen Inhibitors of CD40 Signaling in BL2 Cells Measured in Cell-Based Syste...
Source: Broad Institute
Target: N/A
External Id: 7124-01_Inhibitor_SinglePoint_HTS_Activity
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Name: qHTS of TDP-43 Inhibitors: NCGC Sytravon Library Screen
Source: NCGC
External Id: tdp43-p2-repeat
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This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| 3-(trifluoromethyl)quinoxalin-2(1H)-one |
| 3-(trifluoromethyl)quinoxalin-2-ol |
| trifluoromethylquinoxalinol |
| 2-Hydroxy-3-(trifluoromethyl)quinoxaline |
| 3-trifluoromethyl-2(1H)-quinoxalinone |
| 3-Trifluoromethyl-1H-quinoxalin-2-one |
| 3-(trifluoromethyl)quinoxalin-2-one |
| 2-trifluoromethylquinoxalin-3(4H)-one |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the InChIKey of 3-(trifluoromethyl)-1H-quinoxalin-2-one? |
| A: InChIKey of 3-(trifluoromethyl)-1H-quinoxalin-2-one is NOGLKXWLUDJZDQ-UHFFFAOYSA-N. |
| Q: What is the LogP of 3-(trifluoromethyl)-1H-quinoxalin-2-one? |
| A: LogP of 3-(trifluoromethyl)-1H-quinoxalin-2-one is 2.35420. |
| Q: What is the molecular formula of 3-(trifluoromethyl)-1H-quinoxalin-2-one? |
| A: Molecular formula of 3-(trifluoromethyl)-1H-quinoxalin-2-one is C9H5F3N2O. |
| Q: What is the CAS number of 3-(trifluoromethyl)-1H-quinoxalin-2-one? |
| A: CAS number of 3-(trifluoromethyl)-1H-quinoxalin-2-one is 58457-64-0. |
| Q: What is the SMILES notation of 3-(trifluoromethyl)-1H-quinoxalin-2-one? |
| A: SMILES notation of 3-(trifluoromethyl)-1H-quinoxalin-2-one is O=c1[nH]c2ccccc2nc1C(F)(F)F. |
| Q: What is the molecular weight of 3-(trifluoromethyl)-1H-quinoxalin-2-one? |
| A: Molecular weight of 3-(trifluoromethyl)-1H-quinoxalin-2-one is 214.14400. |
| Q: What English synonyms does 3-(trifluoromethyl)-1H-quinoxalin-2-one have? |
| A: English synonyms of 3-(trifluoromethyl)-1H-quinoxalin-2-one: 3-(trifluoromethyl)quinoxalin-2(1H)-one, 3-(trifluoromethyl)quinoxalin-2-ol, trifluoromethylquinoxalinol, 2-Hydroxy-3-(trifluoromethyl)quinoxaline, 3-trifluoromethyl-2(1H)-quinoxalinone, 3-Trifluoromethyl-1H-quinoxalin-2-one, 3-(trifluoromethyl)quinoxalin-2-one, 2-trifluoromethylquinoxalin-3(4H)-one. |
| Q: What is the English name of 3-(trifluoromethyl)-1H-quinoxalin-2-one? |
| A: The English name of 3-(trifluoromethyl)-1H-quinoxalin-2-one is 3-(trifluoromethyl)-1H-quinoxalin-2-one. |
| Q: What is the polar surface area (PSA) of 3-(trifluoromethyl)-1H-quinoxalin-2-one? |
| A: Polar surface area (PSA) of 3-(trifluoromethyl)-1H-quinoxalin-2-one is 46.01000. |
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. |