3-BROMO-2-FLUORO-1-(TRIFLUOROMETHOXY)BENZENE
3-BROMO-2-FLUORO-1-(TRIFLUOROMETHOXY)BENZENE structure
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Common Name | 3-BROMO-2-FLUORO-1-(TRIFLUOROMETHOXY)BENZENE | ||
|---|---|---|---|---|
| CAS Number | 10410-29-4 | Molecular Weight | 206.19500 | |
| Density | 1.295g/cm3 | Boiling Point | 367.1ºC at 760 mmHg | |
| Molecular Formula | C11H10O4 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | 175.8ºC | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 6-Methoxy-3-methyl-1-benzofuran-2-carboxylic 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 | 1.295g/cm3 |
|---|---|
| Boiling Point | 367.1ºC at 760 mmHg |
| Molecular Formula | C11H10O4 |
| Molecular Weight | 206.19500 |
| Flash Point | 175.8ºC |
| Exact Mass | 206.05800 |
| PSA | 59.67000 |
| LogP | 2.44800 |
| Vapour Pressure | 4.91E-06mmHg at 25°C |
| Index of Refraction | 1.605 |
| InChIKey | CQZZSFNTQLCLJF-UHFFFAOYSA-N |
| SMILES | COc1ccc2c(C)c(C(=O)O)oc2c1 |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
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~10%
3-BROMO-2-FLUOR... CAS#:10410-29-4 |
| Literature: Bioorganic and Medicinal Chemistry, , vol. 18, # 2 p. 909 - 921 |
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3-BROMO-2-FLUOR... CAS#:10410-29-4
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| Literature: Journal of Heterocyclic Chemistry, , vol. 29, # 2 p. 423 - 429 |
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3-BROMO-2-FLUOR... CAS#:10410-29-4 |
| Literature: Heterocycles, , vol. 65, # 12 p. 2937 - 2947 |
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3-BROMO-2-FLUOR... CAS#:10410-29-4 |
| Literature: Heterocycles, , vol. 65, # 12 p. 2937 - 2947 |
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3-BROMO-2-FLUOR... CAS#:10410-29-4 |
| Literature: Journal of the Chemical Society, , p. 665,669 |
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~44%
3-BROMO-2-FLUOR... CAS#:10410-29-4
Detail
Learn More
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| Literature: Journal of Heterocyclic Chemistry, , vol. 29, # 2 p. 423 - 429 |
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3-BROMO-2-FLUOR... CAS#:10410-29-4 |
| Literature: Journal of the Chemical Society, , p. 1594,1598 |
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3-BROMO-2-FLUOR... CAS#:10410-29-4 |
| Literature: Journal of the Chemical Society, , p. 1594,1598 |
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3-BROMO-2-FLUOR... CAS#:10410-29-4 |
| Literature: Journal of the Chemical Society, , p. 1594,1598 |
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 8 | |
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| DownStream 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: 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: Fluorescence-based cell-based primary high throughput screening assay to identify pos...
Source: The Scripps Research Institute Molecular Screening Center
Target: muscarinic acetylcholine receptor M1 [Homo sapiens]
External Id: CHRM1_PAM_FLUO8_1536_1X%ACT PRUN
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Name: Fluorescence polarization-based biochemical high throughput primary assay to identify...
Source: The Scripps Research Institute Molecular Screening Center
Target: RecName: Full=Sialate O-acetylesterase; AltName: Full=H-Lse; AltName: Full=Sialic acid-specific 9-O-acetylesterase; Flags: Precursor [Homo sapiens]
External Id: SIAE_INH_FP_1536_1X%INH PRUN
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This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| 6-methoxy-3-methyl-1-benzofuran-2-carboxylic acid |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the boiling point of 6-Methoxy-3-methyl-1-benzofuran-2-carboxylic acid? |
| A: Boiling point of 6-Methoxy-3-methyl-1-benzofuran-2-carboxylic acid is 367.1ºC at 760 mmHg. |
| Q: What is the SMILES notation of 6-Methoxy-3-methyl-1-benzofuran-2-carboxylic acid? |
| A: SMILES notation of 6-Methoxy-3-methyl-1-benzofuran-2-carboxylic acid is COc1ccc2c(C)c(C(=O)O)oc2c1. |
| Q: What is the molecular weight of 6-Methoxy-3-methyl-1-benzofuran-2-carboxylic acid? |
| A: Molecular weight of 6-Methoxy-3-methyl-1-benzofuran-2-carboxylic acid is 206.19500. |
| Q: What is the polar surface area (PSA) of 6-Methoxy-3-methyl-1-benzofuran-2-carboxylic acid? |
| A: Polar surface area (PSA) of 6-Methoxy-3-methyl-1-benzofuran-2-carboxylic acid is 59.67000. |
| Q: What is the molecular formula of 6-Methoxy-3-methyl-1-benzofuran-2-carboxylic acid? |
| A: Molecular formula of 6-Methoxy-3-methyl-1-benzofuran-2-carboxylic acid is C11H10O4. |
| Q: What is the LogP of 6-Methoxy-3-methyl-1-benzofuran-2-carboxylic acid? |
| A: LogP of 6-Methoxy-3-methyl-1-benzofuran-2-carboxylic acid is 2.44800. |
| Q: What are the upstream materials of 6-Methoxy-3-methyl-1-benzofuran-2-carboxylic acid? |
| A: Related upstream materials(CAS) of 6-Methoxy-3-methyl-1-benzofuran-2-carboxylic acid: 75908-67-7;13246-19-0;2555-28-4;90-33-5;29040-52-6;10410-28-3;150-19-6;6437-63-4. |
| Q: What English synonyms does 6-Methoxy-3-methyl-1-benzofuran-2-carboxylic acid have? |
| A: English synonyms of 6-Methoxy-3-methyl-1-benzofuran-2-carboxylic acid: 6-methoxy-3-methyl-1-benzofuran-2-carboxylic acid. |
| Q: What is the English name of 6-Methoxy-3-methyl-1-benzofuran-2-carboxylic acid? |
| A: The English name of 6-Methoxy-3-methyl-1-benzofuran-2-carboxylic acid is 6-Methoxy-3-methyl-1-benzofuran-2-carboxylic acid. |
| Q: What is the InChIKey of 6-Methoxy-3-methyl-1-benzofuran-2-carboxylic acid? |
| A: InChIKey of 6-Methoxy-3-methyl-1-benzofuran-2-carboxylic acid is CQZZSFNTQLCLJF-UHFFFAOYSA-N. |
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. |