3-chloro-4-methyl-2-oxo-2H-chromen-7-yl acetate
3-chloro-4-methyl-2-oxo-2H-chromen-7-yl acetate structure
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Common Name | 3-chloro-4-methyl-2-oxo-2H-chromen-7-yl acetate | ||
|---|---|---|---|---|
| CAS Number | 64309-74-6 | Molecular Weight | 252.65000 | |
| Density | N/A | Boiling Point | N/A | |
| Molecular Formula | C12H9ClO4 | 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-chloro-4-methyl-2-oxo-2H-chromen-7-yl acetate |
|---|
This table shows physicochemical parameters including melting point, boiling point, density, solubility and optical rotation. Missing data is marked as N/A.
| Molecular Formula | C12H9ClO4 |
|---|---|
| Molecular Weight | 252.65000 |
| Exact Mass | 252.01900 |
| PSA | 56.51000 |
| LogP | 2.68010 |
| InChIKey | ILXHVDFBKJQYGA-UHFFFAOYSA-N |
| SMILES | CC(=O)Oc1ccc2c(C)c(Cl)c(=O)oc2c1 |
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 0 | |
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| DownStream 1 | |
CAS#:6174-86-3This table contains target information, in‑vitro & in‑vivo assay data for this compound.
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Name: Biochemical FP Assay from US Patent US12016863: "Inhibitors of RSV replication and ap...
Source: BindingDB
Target: N/A
External Id: BindingDB_12134_1
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Name: Inhibitors of CDC25B-CDK2/CyclinA interaction
Source: Center for Chemical Genomics, University of Michigan
External Id: MScreen:TargetID_600
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Name: Cell-based high throughput primary assay to identify activators of GPR151
Source: The Scripps Research Institute Molecular Screening Center
Target: RecName: Full=G-protein coupled receptor 151; AltName: Full=G-protein coupled receptor PGR7; AltName: Full=GPCR-2037; AltName: Full=Galanin receptor 4; AltName: Full=Galanin-receptor-like protein; Short=GalRL
External Id: GPR151_PHUNTER_AG_LUMI_1536_1X%ACT
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Name: AlphaScreen-based biochemical high throughput primary assay to identify activators of...
Source: The Scripps Research Institute Molecular Screening Center
Target: N/A
External Id: FBW7_ACT_ALPHA_1536_1X%ACT PRUN
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Name: AlphaScreen-based biochemical high throughput primary assay to identify inhibitors of...
Source: The Scripps Research Institute Molecular Screening Center
External Id: MITF_INH_Alpha_1536_1X%INH PRUN
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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-chloro-4-methyl-2-oxo-2H-chromen-7-yl acetate? |
| A: InChIKey of 3-chloro-4-methyl-2-oxo-2H-chromen-7-yl acetate is ILXHVDFBKJQYGA-UHFFFAOYSA-N. |
| Q: What is the molecular formula of 3-chloro-4-methyl-2-oxo-2H-chromen-7-yl acetate? |
| A: Molecular formula of 3-chloro-4-methyl-2-oxo-2H-chromen-7-yl acetate is C12H9ClO4. |
| Q: What is the CAS number of 3-chloro-4-methyl-2-oxo-2H-chromen-7-yl acetate? |
| A: CAS number of 3-chloro-4-methyl-2-oxo-2H-chromen-7-yl acetate is 64309-74-6. |
| Q: What is the Chinese name of 64309-74-6? |
| A: Chinese name of 64309-74-6 is 64309-74-6. |
| Q: What is the LogP of 3-chloro-4-methyl-2-oxo-2H-chromen-7-yl acetate? |
| A: LogP of 3-chloro-4-methyl-2-oxo-2H-chromen-7-yl acetate is 2.68010. |
| Q: What are the downstream products of 3-chloro-4-methyl-2-oxo-2H-chromen-7-yl acetate? |
| A: Related downstream products(CAS) of 3-chloro-4-methyl-2-oxo-2H-chromen-7-yl acetate: 6174-86-3. |
| Q: What is the molecular weight of 3-chloro-4-methyl-2-oxo-2H-chromen-7-yl acetate? |
| A: Molecular weight of 3-chloro-4-methyl-2-oxo-2H-chromen-7-yl acetate is 252.65000. |
| Q: What is the SMILES notation of 3-chloro-4-methyl-2-oxo-2H-chromen-7-yl acetate? |
| A: SMILES notation of 3-chloro-4-methyl-2-oxo-2H-chromen-7-yl acetate is CC(=O)Oc1ccc2c(C)c(Cl)c(=O)oc2c1. |
| Q: What is the polar surface area (PSA) of 3-chloro-4-methyl-2-oxo-2H-chromen-7-yl acetate? |
| A: Polar surface area (PSA) of 3-chloro-4-methyl-2-oxo-2H-chromen-7-yl acetate is 56.51000. |
| Q: What is the English name of 3-chloro-4-methyl-2-oxo-2H-chromen-7-yl acetate? |
| A: The English name of 3-chloro-4-methyl-2-oxo-2H-chromen-7-yl acetate is 3-chloro-4-methyl-2-oxo-2H-chromen-7-yl acetate. |