3-(4-Chlorophenyl)pentanedioic acid
3-(4-Chlorophenyl)pentanedioic acid structure
|
Common Name | 3-(4-Chlorophenyl)pentanedioic acid | ||
|---|---|---|---|---|
| CAS Number | 35271-74-0 | Molecular Weight | 242.656 | |
| Density | 1.4±0.1 g/cm3 | Boiling Point | 394.4±27.0 °C at 760 mmHg | |
| Molecular Formula | C11H11ClO4 | Melting Point | 164-166°C | |
| MSDS | N/A | Flash Point | 192.3±23.7 °C | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 3-(4-chlorophenyl)pentanedioic 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 | 1.4±0.1 g/cm3 |
|---|---|
| Boiling Point | 394.4±27.0 °C at 760 mmHg |
| Melting Point | 164-166°C |
| Molecular Formula | C11H11ClO4 |
| Molecular Weight | 242.656 |
| Flash Point | 192.3±23.7 °C |
| Exact Mass | 242.034592 |
| PSA | 74.60000 |
| LogP | 1.16 |
| Vapour Pressure | 0.0±1.0 mmHg at 25°C |
| Index of Refraction | 1.579 |
| InChIKey | URXVLIVRJJNJII-UHFFFAOYSA-N |
| SMILES | O=C(O)CC(CC(=O)O)c1ccc(Cl)cc1 |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
|
~64%
3-(4-Chlorophen... CAS#:35271-74-0 |
| Literature: Adamo, Mauro F.A.; Konda, Vivekananda R.; Donati, Donato; Sarti-Fantoni, Piero; Torroba, Tomas Tetrahedron, 2007 , vol. 63, # 39 p. 9741 - 9745 |
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~%
3-(4-Chlorophen... CAS#:35271-74-0 |
| Literature: Journal of Medicinal Chemistry, , vol. 44, # 12 p. 1938 - 1950 |
|
~%
3-(4-Chlorophen... CAS#:35271-74-0 |
| Literature: US2792418 , ; Journal of the American Chemical Society, , vol. 81, p. 5733,5735 |
|
~%
3-(4-Chlorophen... CAS#:35271-74-0 |
| Literature: Journal of Medicinal Chemistry, , vol. 44, # 12 p. 1938 - 1950 |
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 4 | |
|---|---|
| DownStream 2 | |
CAS#:53911-68-5
CAS#:84803-46-3This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2917399090 |
|---|---|
| Summary | 2917399090 aromatic polycarboxylic acids, their anhydrides, halides, peroxides, peroxyacids and their derivatives。Supervision conditions:None。VAT:17.0%。Tax rebate rate:9.0%。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: Dicer-mediated maturation of pre-microRNA
Source: Center for Chemical Genomics, University of Michigan
Target: N/A
External Id: TargetID_659_CEMA
|
|
Name: Screen for inhibitors of RMI FANCM (MM2) intereaction
Source: 11908
Target: N/A
External Id: RMI-FANCM-MM2
|
|
Name: Inhibitors of CDC25B-CDK2/CyclinA interaction
Source: Center for Chemical Genomics, University of Michigan
External Id: MScreen:TargetID_600
|
This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| MFCD00190249 |
| 3-(4-Chlorophenyl)pentanedioic acid |
| 3-(4-chlorophenyl)-pentanedioic acid |
| 3-(4-chloro-phenyl)-glutaric acid |
| EINECS 252-477-1 |
| QV1YR DG&1VQ |
| b-(4-Chlorophenyl) glutaric acid |
| 3-(4-chlorophenyl)pentane-1,5-dioic acid |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the safety information for 3-(4-chlorophenyl)pentanedioic acid? |
| A: Safety information for 3-(4-chlorophenyl)pentanedioic acid: S26-S36. |
| Q: What is the melting point of 3-(4-chlorophenyl)pentanedioic acid? |
| A: Melting point of 3-(4-chlorophenyl)pentanedioic acid is 164-166°C. |
| Q: What is the LogP of 3-(4-chlorophenyl)pentanedioic acid? |
| A: LogP of 3-(4-chlorophenyl)pentanedioic acid is 1.16. |
| Q: What is the CAS number of 3-(4-chlorophenyl)pentanedioic acid? |
| A: CAS number of 3-(4-chlorophenyl)pentanedioic acid is 35271-74-0. |
| Q: What is the boiling point of 3-(4-chlorophenyl)pentanedioic acid? |
| A: Boiling point of 3-(4-chlorophenyl)pentanedioic acid is 394.4±27.0 °C at 760 mmHg. |
| Q: What is the InChIKey of 3-(4-chlorophenyl)pentanedioic acid? |
| A: InChIKey of 3-(4-chlorophenyl)pentanedioic acid is URXVLIVRJJNJII-UHFFFAOYSA-N. |
| Q: What are the upstream materials of 3-(4-chlorophenyl)pentanedioic acid? |
| A: Related upstream materials(CAS) of 3-(4-chlorophenyl)pentanedioic acid: 1123-49-5;104-88-1;101104-10-3;141-97-9. |
| Q: What English synonyms does 3-(4-chlorophenyl)pentanedioic acid have? |
| A: English synonyms of 3-(4-chlorophenyl)pentanedioic acid: MFCD00190249, 3-(4-Chlorophenyl)pentanedioic acid, 3-(4-chlorophenyl)-pentanedioic acid, 3-(4-chloro-phenyl)-glutaric acid, EINECS 252-477-1, QV1YR DG&1VQ, b-(4-Chlorophenyl) glutaric acid, 3-(4-chlorophenyl)pentane-1,5-dioic acid. |
| Q: What are the downstream products of 3-(4-chlorophenyl)pentanedioic acid? |
| A: Related downstream products(CAS) of 3-(4-chlorophenyl)pentanedioic acid: 53911-68-5;84803-46-3. |
| Q: What is the SMILES notation of 3-(4-chlorophenyl)pentanedioic acid? |
| A: SMILES notation of 3-(4-chlorophenyl)pentanedioic acid is O=C(O)CC(CC(=O)O)c1ccc(Cl)cc1. |
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. |