3-Biphenylylacetic acid
3-Biphenylylacetic acid structure
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Common Name | 3-Biphenylylacetic acid | ||
|---|---|---|---|---|
| CAS Number | 23948-77-8 | Molecular Weight | 212.244 | |
| Density | 1.2±0.1 g/cm3 | Boiling Point | 384.6±11.0 °C at 760 mmHg | |
| Molecular Formula | C14H12O2 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | 281.5±14.4 °C | |
Summary: 2-(3-phenylphenyl)acetic acid, also known as 3-biphenylylacetic acid, has a CAS number of 23948-77-8, with molecular formula C14H12O2 and molecular weight 212.244. 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 | 2-(3-phenylphenyl)acetic 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 | 1.2±0.1 g/cm3 |
|---|---|
| Boiling Point | 384.6±11.0 °C at 760 mmHg |
| Molecular Formula | C14H12O2 |
| Molecular Weight | 212.244 |
| Flash Point | 281.5±14.4 °C |
| Exact Mass | 212.083725 |
| PSA | 37.30000 |
| LogP | 3.26 |
| Vapour Pressure | 0.0±0.9 mmHg at 25°C |
| Index of Refraction | 1.596 |
| InChIKey | VLQLJPWPRYUYMK-UHFFFAOYSA-N |
| SMILES | O=C(O)Cc1cccc(-c2ccccc2)c1 |
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.
| Hazard Codes | Xi |
|---|---|
| HS Code | 2916399090 |
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 7 | |
|---|---|
| DownStream 2 | |
CAS#:1878-67-7
CAS#:98-80-6
CAS#:75852-28-7
CAS#:71912-70-4
CAS#:71912-71-5
CAS#:3112-01-4
CAS#:14704-31-5
CAS#:89320-08-1
CAS#:51498-07-8This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2916399090 |
|---|---|
| Summary | 2916399090 other aromatic monocarboxylic acids, their anhydrides, halides, peroxides, peroxyacids and their derivatives 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: AlphaScreen-based biochemical high throughput primary assay to identify inhibitors of...
Source: The Scripps Research Institute Molecular Screening Center
Target: N/A
External Id: ULK1_INH_LUMI_1536_1X%INH PRUN
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Name: uHTS identification of small molecule modulators of Rev-erb Alpha.
Source: Burnham Center for Chemical Genomics
Target: N/A
External Id: SBCCG-A1016-RevErbaLBD-Primary-Assay
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Name: Inhibitory activity on carrageenan-induced paw edema in rats 3h after po administrati...
Source: ChEMBL
Target: Rattus norvegicus
External Id: CHEMBL786502
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Name: Analgesic activity against AcOH writhing after po administration.
Source: ChEMBL
Target: Rattus norvegicus
External Id: CHEMBL783786
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Name: Inhibitory activity on carrageenan-induced paw edema in rats 3h after po administrati...
Source: ChEMBL
Target: Rattus norvegicus
External Id: CHEMBL787889
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Name: Acute toxicity was determined 168 hr after a single ip injection to groups of four ma...
Source: ChEMBL
Target: Mus musculus
External Id: CHEMBL720719
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This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| 3-Biphenylylacetic acid |
| 3-BIPHENYLACETIC ACID |
| [1,1'-Biphenyl]-3-acetic acid |
| 1,1'-biphenyl-3-ylacetic acid |
| Biphenyl-3-ylacetic acid |
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-(3-phenylphenyl)acetic acid? |
| A: Related upstream materials(CAS) of 2-(3-phenylphenyl)acetic acid: 1878-67-7;98-80-6;75852-28-7;71912-70-4;71912-71-5;3112-01-4;14704-31-5. |
| Q: What is the InChIKey of 2-(3-phenylphenyl)acetic acid? |
| A: InChIKey of 2-(3-phenylphenyl)acetic acid is VLQLJPWPRYUYMK-UHFFFAOYSA-N. |
| Q: What is the molecular formula of 2-(3-phenylphenyl)acetic acid? |
| A: Molecular formula of 2-(3-phenylphenyl)acetic acid is C14H12O2. |
| Q: What is the SMILES notation of 2-(3-phenylphenyl)acetic acid? |
| A: SMILES notation of 2-(3-phenylphenyl)acetic acid is O=C(O)Cc1cccc(-c2ccccc2)c1. |
| Q: What is the CAS number of 2-(3-phenylphenyl)acetic acid? |
| A: CAS number of 2-(3-phenylphenyl)acetic acid is 23948-77-8. |
| Q: What is the molecular weight of 2-(3-phenylphenyl)acetic acid? |
| A: Molecular weight of 2-(3-phenylphenyl)acetic acid is 212.244. |
| Q: What is the boiling point of 2-(3-phenylphenyl)acetic acid? |
| A: Boiling point of 2-(3-phenylphenyl)acetic acid is 384.6±11.0 °C at 760 mmHg. |
| Q: What is the English name of 2-(3-phenylphenyl)acetic acid? |
| A: The English name of 2-(3-phenylphenyl)acetic acid is 2-(3-phenylphenyl)acetic acid. |
| Q: What is the LogP of 2-(3-phenylphenyl)acetic acid? |
| A: LogP of 2-(3-phenylphenyl)acetic acid is 3.26. |
| Q: What English synonyms does 2-(3-phenylphenyl)acetic acid have? |
| A: English synonyms of 2-(3-phenylphenyl)acetic acid: 3-Biphenylylacetic acid, 3-BIPHENYLACETIC ACID, [1,1'-Biphenyl]-3-acetic acid, 1,1'-biphenyl-3-ylacetic acid, Biphenyl-3-ylacetic acid. |
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. |