4-Methoxy-6-methyl-2H-pyran-2-one
4-Methoxy-6-methyl-2H-pyran-2-one structure
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Common Name | 4-Methoxy-6-methyl-2H-pyran-2-one | ||
|---|---|---|---|---|
| CAS Number | 672-89-9 | Molecular Weight | 140.13700 | |
| Density | 1.14g/cm3 | Boiling Point | 280.3ºC at 760 mmHg | |
| Molecular Formula | C7H8O3 | Melting Point | 83-86ºC | |
| MSDS | N/A | Flash Point | 112.6ºC | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 4-Methoxy-6-Methyl-2H-Pyran-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 | 1.14g/cm3 |
|---|---|
| Boiling Point | 280.3ºC at 760 mmHg |
| Melting Point | 83-86ºC |
| Molecular Formula | C7H8O3 |
| Molecular Weight | 140.13700 |
| Flash Point | 112.6ºC |
| Exact Mass | 140.04700 |
| PSA | 39.44000 |
| LogP | 0.95680 |
| Appearance of Characters | Solid |
| Index of Refraction | 1.492 |
| InChIKey | MTZAUZNQAMNFME-UHFFFAOYSA-N |
| SMILES | COc1cc(C)oc(=O)c1 |
| Water Solubility | Poorly soluble in water. |
This table provides MSDS information including hazard classification, first‑aid, fire‑fighting, spill handling, operation and storage instructions.
This table summarizes toxicological test data, acute & chronic toxicity and ecological hazard parameters for this chemical.
CHEMICAL IDENTIFICATION
HEALTH HAZARD DATAACUTE TOXICITY DATA
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This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| WGK Germany | 3 |
|---|---|
| RTECS | UQ1225500 |
| HS Code | 2932999099 |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 10 | |
|---|---|
| DownStream 9 | |
CAS#:675-10-5
CAS#:77-78-1
CAS#:512-56-1
CAS#:80-48-8
CAS#:67-64-1
CAS#:186581-53-3
CAS#:67-56-1
CAS#:926-66-9
CAS#:4188-63-0
CAS#:771-03-9
CAS#:500-62-9
CAS#:35598-05-1
CAS#:108593-44-8
CAS#:4179-19-5
CAS#:2743-14-8
CAS#:158205-36-8
CAS#:84016-84-2
CAS#:3155-51-9![4-methoxy-6-[2-(4-methoxyphenyl)ethyl]pyran-2-one structure](https://image.chemsrc.com/caspic/299/3155-52-0.png)
CAS#:3155-52-0This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2932999099 |
|---|---|
| Summary | 2932999099. other heterocyclic compounds with oxygen 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: Induction of apoptosis in human U937 cells assessed as reduction of normal cells at 5...
Source: ChEMBL
Target: U-937
External Id: CHEMBL2209391
|
|
Name: Pro-oxidant activity in 0.1 M potassium phosphate buffer at pH 7.4 assessed as increa...
Source: ChEMBL
Target: N/A
External Id: CHEMBL2216504
|
|
Name: Induction of cell differentiation in human U937 cells assessed as increase of CD11b a...
Source: ChEMBL
Target: U-937
External Id: CHEMBL2216511
|
This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| MFCD00006640 |
| 4-methoxy-6-methylpyran-2-one |
| EINECS 211-600-9 |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What English synonyms does 4-Methoxy-6-Methyl-2H-Pyran-2-One have? |
| A: English synonyms of 4-Methoxy-6-Methyl-2H-Pyran-2-One: MFCD00006640, 4-methoxy-6-methylpyran-2-one, EINECS 211-600-9. |
| Q: How is the water solubility of 4-Methoxy-6-Methyl-2H-Pyran-2-One? |
| A: Water solubility of 4-Methoxy-6-Methyl-2H-Pyran-2-One: Poorly soluble in water. |
| Q: What is the melting point of 4-Methoxy-6-Methyl-2H-Pyran-2-One? |
| A: Melting point of 4-Methoxy-6-Methyl-2H-Pyran-2-One is 83-86ºC. |
| Q: What is the polar surface area (PSA) of 4-Methoxy-6-Methyl-2H-Pyran-2-One? |
| A: Polar surface area (PSA) of 4-Methoxy-6-Methyl-2H-Pyran-2-One is 39.44000. |
| Q: What is the physical appearance of 4-Methoxy-6-Methyl-2H-Pyran-2-One? |
| A: 4-Methoxy-6-Methyl-2H-Pyran-2-One appears as Solid. |
| Q: What is the SMILES notation of 4-Methoxy-6-Methyl-2H-Pyran-2-One? |
| A: SMILES notation of 4-Methoxy-6-Methyl-2H-Pyran-2-One is COc1cc(C)oc(=O)c1. |
| Q: What is the CAS number of 4-Methoxy-6-Methyl-2H-Pyran-2-One? |
| A: CAS number of 4-Methoxy-6-Methyl-2H-Pyran-2-One is 672-89-9. |
| Q: What is the InChIKey of 4-Methoxy-6-Methyl-2H-Pyran-2-One? |
| A: InChIKey of 4-Methoxy-6-Methyl-2H-Pyran-2-One is MTZAUZNQAMNFME-UHFFFAOYSA-N. |
| Q: What is the molecular formula of 4-Methoxy-6-Methyl-2H-Pyran-2-One? |
| A: Molecular formula of 4-Methoxy-6-Methyl-2H-Pyran-2-One is C7H8O3. |
| Q: What are the upstream materials of 4-Methoxy-6-Methyl-2H-Pyran-2-One? |
| A: Related upstream materials(CAS) of 4-Methoxy-6-Methyl-2H-Pyran-2-One: 675-10-5;77-78-1;512-56-1;80-48-8;67-64-1;186581-53-3;67-56-1;926-66-9;4188-63-0;771-03-9. |
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. |