2-Methylcyclopentane-1,3-dione
2-Methylcyclopentane-1,3-dione structure
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Common Name | 2-Methylcyclopentane-1,3-dione | ||
|---|---|---|---|---|
| CAS Number | 765-69-5 | Molecular Weight | 112.127 | |
| Density | 1.1±0.1 g/cm3 | Boiling Point | 218.0±23.0 °C at 760 mmHg | |
| Molecular Formula | C6H8O2 | Melting Point | 212-215 °C(lit.) | |
| MSDS | Chinese USA | Flash Point | 78.5±19.6 °C | |
Use of 2-Methylcyclopentane-1,3-dione2-Methylcyclopentane-1,3-dione is a key intermediate for the total synthesis of steroids[1]. |
| Name | 2-Methyl-1,3-cyclopentanedione |
|---|---|
| Synonym | More Synonyms |
| Description | 2-Methylcyclopentane-1,3-dione is a key intermediate for the total synthesis of steroids[1]. |
|---|---|
| Related Catalog | |
| References |
| Density | 1.1±0.1 g/cm3 |
|---|---|
| Boiling Point | 218.0±23.0 °C at 760 mmHg |
| Melting Point | 212-215 °C(lit.) |
| Molecular Formula | C6H8O2 |
| Molecular Weight | 112.127 |
| Flash Point | 78.5±19.6 °C |
| Exact Mass | 112.052429 |
| PSA | 34.14000 |
| LogP | -0.78 |
| Vapour Pressure | 0.1±0.4 mmHg at 25°C |
| Index of Refraction | 1.463 |
| InChIKey | HXZILEQYFQYQCE-UHFFFAOYSA-N |
| SMILES | CC1C(=O)CCC1=O |
| Personal Protective Equipment | Eyeshields;Gloves;type N95 (US);type P1 (EN143) respirator filter |
|---|---|
| Hazard Codes | Xi |
| Risk Phrases | R36/37/38 |
| Safety Phrases | S22-S24/25 |
| RIDADR | NONH for all modes of transport |
| WGK Germany | 3 |
| HS Code | 29142900 |
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2-Methylcyclope... CAS#:765-69-5 |
| Literature: Angewandte Chemie - International Edition, , vol. 46, # 21 p. 3966 - 3970 |
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2-Methylcyclope... CAS#:765-69-5
Learn More
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| Literature: Journal of the American Chemical Society, , vol. 65, p. 2296,2298 |
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2-Methylcyclope... CAS#:765-69-5 |
| Literature: Journal of the American Chemical Society, , vol. 65, p. 2296,2298 |
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2-Methylcyclope... CAS#:765-69-5 |
| Literature: Isart, Carles; Bastida, David; Bures, Jordi; Vilarrasa, Jaume Angewandte Chemie - International Edition, 2011 , vol. 50, # 14 p. 3275 - 3279 |
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2-Methylcyclope... CAS#:765-69-5 |
| Literature: Synthetic Communications, , vol. 19, # 3and4 p. 373 - 378 |
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2-Methylcyclope... CAS#:765-69-5 |
| Literature: Journal of Organic Chemistry, , vol. 47, # 23 p. 4491 - 4498 |
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2-Methylcyclope... CAS#:765-69-5 |
| Literature: Bulletin de la Societe Chimique de France, , p. 1036 Organic Syntheses, , vol. Coll. Vol. V, p. 747 |
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2-Methylcyclope... CAS#:765-69-5 |
| Literature: Australian Journal of Chemistry, , vol. 35, # 4 p. 799 - 808 |
| Precursor 7 | |
|---|---|
| DownStream 10 | |
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CAS#:33879-04-8| HS Code | 2914299000 |
|---|---|
| Summary | 2914299000. other cyclanic, cyclenic or cyclotherpenic ketones without other oxygen function. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:5.5%. General tariff:30.0% |
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J. Med. Chem. 48 , 2906-15, (2005) Carboxylesterases (CE) are ubiquitous enzymes responsible for the metabolism of xenobiotics. Because the structural and amino acid homology among esterases of different classes, the identification of ... |
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Dyotropic rearrangements of fused tricyclic β-lactones: application to the synthesis of (-)-curcumanolide A and (-)-curcumalactone.
J. Am. Chem. Soc. 134(32) , 13348-56, (2012) Dyotropic rearrangements of fused, tricyclic β-lactones are described that proceed via unprecedented stereospecific, 1,2-acyl migrations delivering bridged, spiro-γ-butyrolactones. A unique example of... |
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Name: Inhibition constant against human Acetylcholinesterase (hAcChE) using acetylthiocholi...
Source: ChEMBL
Target: Acetylcholinesterase
External Id: CHEMBL829841
|
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Name: Inhibition constant against human intestinal carboxylesterase 2 (hiCE) using nitrophe...
Source: ChEMBL
Target: Cocaine esterase
External Id: CHEMBL839684
|
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Name: Enzyme Inhibition Assay from Article 10.1021/jm049011j: "Identification and character...
Source: BindingDB
Target: N/A
External Id: BindingDB_2621_1
|
|
Name: Inhibition constant against rabbit liver carboxylesterase (rCE) using nitrophenyl ace...
Source: ChEMBL
Target: Liver carboxylesterase 1
External Id: CHEMBL828256
|
|
Name: Inhibition constant against human Butyrylcholinesterase (hBuChE) using butyrylthiocho...
Source: ChEMBL
Target: Cholinesterase
External Id: CHEMBL828255
|
|
Name: Inhibition constant against human liver carboxylesterase 1 (hCE1) using nitrophenyl a...
Source: ChEMBL
Target: Liver carboxylesterase 1
External Id: CHEMBL828284
|
| 2-methyl-1,3-cyclo-pentanedione |
| 2-Methylcyclopentan-1,3-dion |
| Cyclopentanecarbonylchloride,2-methyl |
| MFCD00001406 |
| 2-methylcyclopentane-1,3-dione |
| 2-Methyl-1,3-cyclopentanedione |
| 2-methylcyclopentanecarbonyl chloride |
| 2-methyl-cyclopentane-1,3-dione |
| 2-methyl-cyclopentan-1,3-dione |
| EINECS 212-153-2 |
| 2-Methyl-1,3-cyclopentadione |
| 2-Methyl-cyclopentan-1-carbonsaeure-chlorid |