(S)-2-Benzylsuccinic acid
(S)-2-Benzylsuccinic acid structure
|
Common Name | (S)-2-Benzylsuccinic acid | ||
|---|---|---|---|---|
| CAS Number | 3972-36-9 | Molecular Weight | 208.211 | |
| Density | 1.3±0.1 g/cm3 | Boiling Point | 331.4±22.0 °C at 760 mmHg | |
| Molecular Formula | C11H12O4 | Melting Point | 166 °C | |
| MSDS | N/A | Flash Point | 168.4±18.8 °C | |
Summary: (S)-2-Benzylsuccinic Acid, also known as S-2-Benzylsuccinic acid, with molecular formula C11H12O4 and molecular weight 208.211, CAS number 3972-36-9. It appears as a white to almost white powder or crystal, with a melting point of 166°C and a boiling point of 331.4±22.0°C, and a density of 1.3±0.1g/cm3. For research-use only, not for medical or clinical usage.
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | (S)-2-Benzylsuccinic 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 | 1.3±0.1 g/cm3 |
|---|---|
| Boiling Point | 331.4±22.0 °C at 760 mmHg |
| Melting Point | 166 °C |
| Molecular Formula | C11H12O4 |
| Molecular Weight | 208.211 |
| Flash Point | 168.4±18.8 °C |
| Exact Mass | 208.073563 |
| PSA | 74.60000 |
| LogP | 1.60 |
| Vapour Pressure | 0.0±0.8 mmHg at 25°C |
| Index of Refraction | 1.568 |
| InChIKey | GTOFKXZQQDSVFH-VIFPVBQESA-N |
| SMILES | O=C(O)CC(Cc1ccccc1)C(=O)O |
This table provides MSDS information including hazard classification, first‑aid, fire‑fighting, spill handling, operation and storage instructions.
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| Hazard Codes | Xi |
|---|---|
| HS Code | 2917399090 |
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 9 | |
|---|---|
| DownStream 1 | |
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CAS#:145375-43-5This 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 collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| (2S)-2-Benzylsuccinic acid |
| 2-Benzylsuccinic acid |
| Benzyl butanedioic acid |
| S-2-Benzylsuccinic acid |
| (S)-2-benzylsuccinic acid |
| (2S)-2-benzylbutanedioic acid |
| (S)-2-Benzylsuccinicacid |
| (S)-Benzylsuccinic Acid |
| 2-benzylbutanedioic acid |
| MFCD00798341 |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What are the downstream products of (S)-2-Benzylsuccinic Acid? |
| A: Related downstream products(CAS) of (S)-2-Benzylsuccinic Acid: 145375-43-5. |
| Q: What is the SMILES notation of (S)-2-Benzylsuccinic Acid? |
| A: SMILES notation of (S)-2-Benzylsuccinic Acid is O=C(O)CC(Cc1ccccc1)C(=O)O. |
| Q: What is the CAS number of (S)-2-Benzylsuccinic Acid? |
| A: CAS number of (S)-2-Benzylsuccinic Acid is 3972-36-9. |
| Q: What is the English name of (S)-2-Benzylsuccinic Acid? |
| A: The English name of (S)-2-Benzylsuccinic Acid is (S)-2-Benzylsuccinic Acid. |
| Q: What is the LogP of (S)-2-Benzylsuccinic Acid? |
| A: LogP of (S)-2-Benzylsuccinic Acid is 1.60. |
| Q: What is the polar surface area (PSA) of (S)-2-Benzylsuccinic Acid? |
| A: Polar surface area (PSA) of (S)-2-Benzylsuccinic Acid is 74.60000. |
| Q: What are the upstream materials of (S)-2-Benzylsuccinic Acid? |
| A: Related upstream materials(CAS) of (S)-2-Benzylsuccinic Acid: 65756-81-2;5653-88-3;140903-48-6;36092-42-9;787635-23-8;65756-82-3;100-52-7;337518-87-3;123191-44-6. |
| Q: What English synonyms does (S)-2-Benzylsuccinic Acid have? |
| A: English synonyms of (S)-2-Benzylsuccinic Acid: (2S)-2-Benzylsuccinic acid, 2-Benzylsuccinic acid, Benzyl butanedioic acid, S-2-Benzylsuccinic acid, (S)-2-benzylsuccinic acid, (2S)-2-benzylbutanedioic acid, (S)-2-Benzylsuccinicacid, (S)-Benzylsuccinic Acid, 2-benzylbutanedioic acid, MFCD00798341. |
| Q: What is the melting point of (S)-2-Benzylsuccinic Acid? |
| A: Melting point of (S)-2-Benzylsuccinic Acid is 166 °C. |
| Q: What is the InChIKey of (S)-2-Benzylsuccinic Acid? |
| A: InChIKey of (S)-2-Benzylsuccinic Acid is GTOFKXZQQDSVFH-VIFPVBQESA-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. |
| Henan Tianfu Chemical Co., Ltd. |