3-(3-Phenyl-1,2,4-oxadiazol-5-yl)propanoic acid
3-(3-Phenyl-1,2,4-oxadiazol-5-yl)propanoic acid structure
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Common Name | 3-(3-Phenyl-1,2,4-oxadiazol-5-yl)propanoic acid | ||
|---|---|---|---|---|
| CAS Number | 24088-59-3 | Molecular Weight | 218.20900 | |
| Density | 1.299g/cm3 | Boiling Point | 433.4ºC at 760mmHg | |
| Molecular Formula | C11H10N2O3 | Melting Point | 119-120 °C | |
| MSDS | N/A | Flash Point | 215.9ºC | |
Summary: 3-(3-Phenyl-1,2,4-oxadiazol-5-yl)propanoic acid, also known as 3-(3-phenyl-1,2,4-oxadiazol-5-yl)propionic acid, has a CAS number of 24088-59-3, with a molecular formula of C11H10N2O3 and a molecular weight of 218.21. The melting point is 119-120°C, and the density is 1.299g/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 | 3-(3-Phenyl-1,2,4-oxadiazol-5-yl)propanoic 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 | 1.299g/cm3 |
|---|---|
| Boiling Point | 433.4ºC at 760mmHg |
| Melting Point | 119-120 °C |
| Molecular Formula | C11H10N2O3 |
| Molecular Weight | 218.20900 |
| Flash Point | 215.9ºC |
| Exact Mass | 218.06900 |
| PSA | 76.22000 |
| LogP | 1.75380 |
| Vapour Pressure | 2.79E-08mmHg at 25°C |
| InChIKey | UBSBRLFVQKHLPG-UHFFFAOYSA-N |
| SMILES | O=C(O)CCc1nc(-c2ccccc2)no1 |
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| Hazard Codes | Xn |
|---|---|
| HS Code | 2934999090 |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
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~87%
3-(3-Phenyl-1,2... CAS#:24088-59-3 |
| Literature: INCYTE CORPORATION Patent: WO2007/15744 A1, 2007 ; Location in patent: Page/Page column 63-64 ; WO 2007/015744 A1 |
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~%
3-(3-Phenyl-1,2... CAS#:24088-59-3 |
| Literature: Journal of Heterocyclic Chemistry, , vol. 46, # 5 p. 980 - 987 |
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~%
3-(3-Phenyl-1,2... CAS#:24088-59-3 |
| Literature: Heterocycles, , vol. 51, # 12 p. 2961 - 2967 |
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~73%
Detail
Learn More
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| Literature: Neves Filho, Ricardo Antonio Wanderley; Da Silva, Cecilia Aguiar; Da Silva, Clecia Sipriano Borges; Brustein, Vanessa Passos; Navarro, Daniela Maria Do Amaral Ferraz; Dos Santos, Fabio Andre Brayner; Alves, Luiz Carlos; Cavalcanti, Marilia Gabriela Dos Santos; Srivastava, Rajendra Mohan; Carneiro-Da-Cunha, Maria Das Gracas Chemical and Pharmaceutical Bulletin, 2009 , vol. 57, # 8 p. 819 - 825 |
![3-phenyl-5-[2-(3-phenyl-1,2,4-oxadiazol-5-yl)ethyl]-1,2,4-oxadiazole structure](https://image.chemsrc.com/caspic/480/22020-64-0.png)
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 4 | |
|---|---|
| DownStream 0 | |
This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2934999090 |
|---|---|
| Summary | 2934999090. other heterocyclic compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0% |
This table contains target information, in‑vitro & in‑vivo assay data for this compound.
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Name: Primary cell-based high-throughput screening assay for identification of compounds th...
Source: Johns Hopkins Ion Channel Center
Target: regulator of G-protein signaling 4 isoform 2 [Homo sapiens]
External Id: JHICC_RGS_Act_HTS
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Name: Luminescence-based cell-based primary high throughput screening assay to identify ago...
Source: The Scripps Research Institute Molecular Screening Center
Target: mu-type opioid receptor isoform MOR-1 [Homo sapiens]
External Id: OPRM1-OPRD1_AG_LUMI_1536_1X%ACT PRUN
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Name: QFRET-based biochemical primary high throughput screening assay to identify exosite i...
Source: The Scripps Research Institute Molecular Screening Center
Target: disintegrin and metalloproteinase domain-containing protein 17 preproprotein [Homo sapiens]
External Id: ADAM17_INH_QFRET_1536_1X%INH PRUN
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Name: Fluorescence-based cell-based primary high throughput screening assay to identify ago...
Source: The Scripps Research Institute Molecular Screening Center
Target: muscarinic acetylcholine receptor M1 [Homo sapiens]
External Id: CHRM1_AG_FLUO8_1536_1X%ACT PRUN
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Name: uHTS identification of small molecule activators of the adaptive arm of the Unfolded ...
Source: Burnham Center for Chemical Genomics
Target: N/A
External Id: BCCG-A405-UPR-XBP1-PrimaryAgonist-Assay
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Name: High throughput fluorescence intensity-based biochemical assay to screen for small mo...
Source: University of Pittsburgh Molecular Library Screening Center
Target: furin (paired basic amino acid cleaving enzyme), isoform CRA_a [Homo sapiens]
External Id: MH080376 Biochemical HTS for Inhibitors of the Proprotein Convertase Furin.
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Name: Fluorescence polarization to screen for inhibitor that competite the binding of FadD2...
Source: Broad Institute
Target: FATTY-ACID-CoA LIGASE FADD28 (FATTY-ACID-CoA SYNTHETASE)
External Id: 2147-01_Inhibitor_SinglePoint_HTS_Activity
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Name: Fluorescence-based cell-based primary high throughput screening assay to identify pos...
Source: The Scripps Research Institute Molecular Screening Center
Target: muscarinic acetylcholine receptor M1 [Homo sapiens]
External Id: CHRM1_PAM_FLUO8_1536_1X%ACT PRUN
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Name: Fluorescence polarization-based biochemical high throughput primary assay to identify...
Source: The Scripps Research Institute Molecular Screening Center
Target: RecName: Full=Sialate O-acetylesterase; AltName: Full=H-Lse; AltName: Full=Sialic acid-specific 9-O-acetylesterase; Flags: Precursor [Homo sapiens]
External Id: SIAE_INH_FP_1536_1X%INH PRUN
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Name: Absorbance-based primary biochemical high throughput screening assay to identify acti...
Source: The Scripps Research Institute Molecular Screening Center
Target: caspase-3 preproprotein [Homo sapiens]
External Id: PROCASPASE3_ACT_EPIABS_1536_1X%ACT PRUN
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This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| 3-(Phenyl-[1,2,4]oxadiazol-5-yl)-propionsaeure |
| 3-<(3-Phenyl)-1,2,4-oxadiazol-5-yl>propionic acid |
| 3-(3-phenyl-1,2,4-oxadiazol 5-yl)-propanoic acid |
| 3-(phenyl-[1,2,4]oxadiazol-5-yl)-propionic acid |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the melting point of 3-(3-Phenyl-1,2,4-oxadiazol-5-yl)propanoic acid? |
| A: Melting point of 3-(3-Phenyl-1,2,4-oxadiazol-5-yl)propanoic acid is 119-120 °C. |
| Q: What is the molecular formula of 3-(3-Phenyl-1,2,4-oxadiazol-5-yl)propanoic acid? |
| A: Molecular formula of 3-(3-Phenyl-1,2,4-oxadiazol-5-yl)propanoic acid is C11H10N2O3. |
| Q: What is the boiling point of 3-(3-Phenyl-1,2,4-oxadiazol-5-yl)propanoic acid? |
| A: Boiling point of 3-(3-Phenyl-1,2,4-oxadiazol-5-yl)propanoic acid is 433.4ºC at 760mmHg. |
| Q: What is the molecular weight of 3-(3-Phenyl-1,2,4-oxadiazol-5-yl)propanoic acid? |
| A: Molecular weight of 3-(3-Phenyl-1,2,4-oxadiazol-5-yl)propanoic acid is 218.20900. |
| Q: What is the English name of 3-(3-Phenyl-1,2,4-oxadiazol-5-yl)propanoic acid? |
| A: The English name of 3-(3-Phenyl-1,2,4-oxadiazol-5-yl)propanoic acid is 3-(3-Phenyl-1,2,4-oxadiazol-5-yl)propanoic acid. |
| Q: What is the InChIKey of 3-(3-Phenyl-1,2,4-oxadiazol-5-yl)propanoic acid? |
| A: InChIKey of 3-(3-Phenyl-1,2,4-oxadiazol-5-yl)propanoic acid is UBSBRLFVQKHLPG-UHFFFAOYSA-N. |
| Q: What is the CAS number of 3-(3-Phenyl-1,2,4-oxadiazol-5-yl)propanoic acid? |
| A: CAS number of 3-(3-Phenyl-1,2,4-oxadiazol-5-yl)propanoic acid is 24088-59-3. |
| Q: What are the upstream materials of 3-(3-Phenyl-1,2,4-oxadiazol-5-yl)propanoic acid? |
| A: Related upstream materials(CAS) of 3-(3-Phenyl-1,2,4-oxadiazol-5-yl)propanoic acid: 108-30-5;613-92-3;155500-79-1;100-47-0. |
| Q: What is the polar surface area (PSA) of 3-(3-Phenyl-1,2,4-oxadiazol-5-yl)propanoic acid? |
| A: Polar surface area (PSA) of 3-(3-Phenyl-1,2,4-oxadiazol-5-yl)propanoic acid is 76.22000. |
| Q: What is the LogP of 3-(3-Phenyl-1,2,4-oxadiazol-5-yl)propanoic acid? |
| A: LogP of 3-(3-Phenyl-1,2,4-oxadiazol-5-yl)propanoic acid is 1.75380. |
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. |