1- Phthalimido-4-pentanone structure
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Common Name | 1- Phthalimido-4-pentanone | ||
|---|---|---|---|---|
| CAS Number | 3197-25-9 | Molecular Weight | 231.247 | |
| Density | 1.2±0.1 g/cm3 | Boiling Point | 385.1±25.0 °C at 760 mmHg | |
| Molecular Formula | C13H13NO3 | Melting Point | 74-75ºC | |
| MSDS | N/A | Flash Point | 175.5±15.5 °C | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 2-(4-Oxopentyl)-1H-isoindole-1,3(2H)-dione |
|---|---|
| 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 | 1.2±0.1 g/cm3 |
|---|---|
| Boiling Point | 385.1±25.0 °C at 760 mmHg |
| Melting Point | 74-75ºC |
| Molecular Formula | C13H13NO3 |
| Molecular Weight | 231.247 |
| Flash Point | 175.5±15.5 °C |
| Exact Mass | 231.089539 |
| PSA | 54.45000 |
| LogP | 1.71 |
| Vapour Pressure | 0.0±0.9 mmHg at 25°C |
| Index of Refraction | 1.566 |
| InChIKey | DPATUMDQWSJANG-UHFFFAOYSA-N |
| SMILES | CC(=O)CCCN1C(=O)c2ccccc2C1=O |
| Storage condition | 2-8°C |
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| HS Code | 2925190090 |
|---|
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
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~85%
1- Phthalimido-... CAS#:3197-25-9 |
| Literature: SMITHKLINE BEECHAM P.L.C. Patent: WO2003/93239 A2, 2003 ; Location in patent: Page/Page column 7 ; |
|
~67%
1- Phthalimido-... CAS#:3197-25-9 |
| Literature: Zyryanov, Grigory V.; Kinstle, Thomas H.; Anzenbacher Jr., Pavel Synlett, 2008 , # 8 p. 1171 - 1174 |
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~67%
1- Phthalimido-... CAS#:3197-25-9 |
| Literature: ELI LILLY AND COMPANY Patent: EP835869 A2, 1998 ; |
|
~%
1- Phthalimido-... CAS#:3197-25-9 |
| Literature: US6218415 B1, ; |
|
~17%
1- Phthalimido-... CAS#:3197-25-9 |
| Literature: Journal of Organic Chemistry, , vol. 73, # 7 p. 2875 - 2878 |
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~%
1- Phthalimido-... CAS#:3197-25-9 |
| Literature: Journal of Organic Chemistry, , vol. 17, p. 149,153 |
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 5 | |
|---|---|
| DownStream 5 | |
This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2925190090 |
|---|---|
| Summary | 2925190090 other imides and their derivatives; salts thereof VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0% |
This table contains target information, in‑vitro & in‑vivo assay data for this compound.
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Name: Screen for inhibitors of RMI FANCM (MM2) intereaction
Source: 11908
Target: N/A
External Id: RMI-FANCM-MM2
|
|
Name: NCI human tumor cell line growth inhibition assay. Data for the MCF7 Non-Small Cell L...
Source: DTP/NCI
Target: N/A
External Id: MCF7_OneDose
|
|
Name: Hypolipidemic activity (14th day serum triglyceride) at 20 mg/kg in CF1 male mice
Source: ChEMBL
Target: Mus musculus
External Id: CHEMBL731617
|
|
Name: NCI human tumor cell line growth inhibition assay. Data for the IGROV1 Non-Small Cell...
Source: DTP/NCI
Target: N/A
External Id: IGROV1_OneDose
|
|
Name: Hypolipidemic activity (9th day serum cholesterol) at 20 mg/kg in CF1 male mice
Source: ChEMBL
Target: Mus musculus
External Id: CHEMBL731619
|
|
Name: Hypolipidemic activity (16th day serum cholesterol) at 20 mg/kg in CF1 male mice
Source: ChEMBL
Target: Mus musculus
External Id: CHEMBL731618
|
This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| 2-(4-Oxopentyl)-1H-isoindole-1,3(2H)-dione |
| 1- Phthalimido-4-pentanone |
| 2-(4-oxopentyl)isoindole-1,3-dione |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What are the upstream materials of 2-(4-Oxopentyl)-1H-isoindole-1,3(2H)-dione? |
| A: Related upstream materials(CAS) of 2-(4-Oxopentyl)-1H-isoindole-1,3(2H)-dione: 5891-21-4;1074-82-4;141-78-6;6097-07-0;872791-67-8. |
| Q: What are the downstream products of 2-(4-Oxopentyl)-1H-isoindole-1,3(2H)-dione? |
| A: Related downstream products(CAS) of 2-(4-Oxopentyl)-1H-isoindole-1,3(2H)-dione: 41306-64-3;112357-34-3;142457-00-9;36507-31-0;441-91-8. |
| Q: What is the molecular weight of 2-(4-Oxopentyl)-1H-isoindole-1,3(2H)-dione? |
| A: Molecular weight of 2-(4-Oxopentyl)-1H-isoindole-1,3(2H)-dione is 231.247. |
| Q: What is the SMILES notation of 2-(4-Oxopentyl)-1H-isoindole-1,3(2H)-dione? |
| A: SMILES notation of 2-(4-Oxopentyl)-1H-isoindole-1,3(2H)-dione is CC(=O)CCCN1C(=O)c2ccccc2C1=O. |
| Q: What is the boiling point of 2-(4-Oxopentyl)-1H-isoindole-1,3(2H)-dione? |
| A: Boiling point of 2-(4-Oxopentyl)-1H-isoindole-1,3(2H)-dione is 385.1±25.0 °C at 760 mmHg. |
| Q: What is the English name of 2-(4-Oxopentyl)-1H-isoindole-1,3(2H)-dione? |
| A: The English name of 2-(4-Oxopentyl)-1H-isoindole-1,3(2H)-dione is 2-(4-Oxopentyl)-1H-isoindole-1,3(2H)-dione. |
| Q: What are the storage conditions for 2-(4-Oxopentyl)-1H-isoindole-1,3(2H)-dione? |
| A: Storage conditions for 2-(4-Oxopentyl)-1H-isoindole-1,3(2H)-dione: 2-8°C. |
| Q: What is the melting point of 2-(4-Oxopentyl)-1H-isoindole-1,3(2H)-dione? |
| A: Melting point of 2-(4-Oxopentyl)-1H-isoindole-1,3(2H)-dione is 74-75ºC. |
| Q: What is the LogP of 2-(4-Oxopentyl)-1H-isoindole-1,3(2H)-dione? |
| A: LogP of 2-(4-Oxopentyl)-1H-isoindole-1,3(2H)-dione is 1.71. |
| Q: What is the InChIKey of 2-(4-Oxopentyl)-1H-isoindole-1,3(2H)-dione? |
| A: InChIKey of 2-(4-Oxopentyl)-1H-isoindole-1,3(2H)-dione is DPATUMDQWSJANG-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. |