3-(3-METHOXY-5-ISOXAZOLYL)PROPANOIC ACID
3-(3-METHOXY-5-ISOXAZOLYL)PROPANOIC ACID structure
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Common Name | 3-(3-METHOXY-5-ISOXAZOLYL)PROPANOIC ACID | ||
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| CAS Number | 52898-06-3 | Molecular Weight | 171.151 | |
| Density | 1.3±0.1 g/cm3 | Boiling Point | 349.5±27.0 °C at 760 mmHg | |
| Molecular Formula | C7H9NO4 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | 165.2±23.7 °C | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 3-(3-methoxy-1,2-oxazol-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 | 1.3±0.1 g/cm3 |
|---|---|
| Boiling Point | 349.5±27.0 °C at 760 mmHg |
| Molecular Formula | C7H9NO4 |
| Molecular Weight | 171.151 |
| Flash Point | 165.2±23.7 °C |
| Exact Mass | 171.053162 |
| PSA | 72.56000 |
| LogP | 0.39 |
| Vapour Pressure | 0.0±0.8 mmHg at 25°C |
| Index of Refraction | 1.497 |
| InChIKey | XWBIAAGRBWFOCT-UHFFFAOYSA-N |
| SMILES | COc1cc(CCC(=O)O)on1 |
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| HS Code | 2934999090 |
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This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
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3-(3-METHOXY-5-... CAS#:52898-06-3 |
| Literature: Justus Liebigs Annalen der Chemie, , vol. 369, p. 303 |
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 1 | |
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| DownStream 3 | |
CAS#:16880-23-2
CAS#:75989-15-0
CAS#:75989-19-4This 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: Antibacterial activity against Klebsiella pneumoniae MDR ATCC 70063 (CO-ADD:GN_003); ...
Source: ChEMBL
Target: Klebsiella pneumoniae
External Id: CHEMBL4296186
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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: Bursicon-induced LGR2 mediated cAMP production in LGR-2/CRE6x-Luciferase co-transfect...
Source: Broad Institute
Target: N/A
External Id: Bursicon-induced LGR2 mediated cAMP production in LGR-2/CRE6x-Luciferase co-transfected HEK293 cells Inhibition - 7011-01_Antagonist_SinglePoint_HTS_Activity
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Name: Identifying Sarm1 TIR NADase inhibitors through high throughput HPLC assay
Source: 24386
Target: N/A
External Id: Sarm1 TIR NADase inhibitors
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This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| 3-(3-Methoxy-1,2-oxazol-5-yl)propanoic acid |
| 3-(3-Methoxy-isoxazol-5-yl)-propionic acid |
| 3-(3-methoxy-5-isoxazolyl)propanoic acid |
| 3-methoxyisoxazol-5-ylpropionic acid |
| 3-Methoxy-5-isoxazolepropanoic acid |
| 3-(3-Methoxy-isoxazol-5-yl)-propionsaeure |
| 3-(3-methoxyisoxazol-5-yl)propanoic acid |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the molecular formula of 3-(3-methoxy-1,2-oxazol-5-yl)propanoic acid? |
| A: Molecular formula of 3-(3-methoxy-1,2-oxazol-5-yl)propanoic acid is C7H9NO4. |
| Q: What is the English name of 3-(3-methoxy-1,2-oxazol-5-yl)propanoic acid? |
| A: The English name of 3-(3-methoxy-1,2-oxazol-5-yl)propanoic acid is 3-(3-methoxy-1,2-oxazol-5-yl)propanoic acid. |
| Q: What is the polar surface area (PSA) of 3-(3-methoxy-1,2-oxazol-5-yl)propanoic acid? |
| A: Polar surface area (PSA) of 3-(3-methoxy-1,2-oxazol-5-yl)propanoic acid is 72.56000. |
| Q: What are the downstream products of 3-(3-methoxy-1,2-oxazol-5-yl)propanoic acid? |
| A: Related downstream products(CAS) of 3-(3-methoxy-1,2-oxazol-5-yl)propanoic acid: 16880-23-2;75989-15-0;75989-19-4. |
| Q: What is the boiling point of 3-(3-methoxy-1,2-oxazol-5-yl)propanoic acid? |
| A: Boiling point of 3-(3-methoxy-1,2-oxazol-5-yl)propanoic acid is 349.5±27.0 °C at 760 mmHg. |
| Q: What is the SMILES notation of 3-(3-methoxy-1,2-oxazol-5-yl)propanoic acid? |
| A: SMILES notation of 3-(3-methoxy-1,2-oxazol-5-yl)propanoic acid is COc1cc(CCC(=O)O)on1. |
| Q: What is the CAS number of 3-(3-methoxy-1,2-oxazol-5-yl)propanoic acid? |
| A: CAS number of 3-(3-methoxy-1,2-oxazol-5-yl)propanoic acid is 52898-06-3. |
| Q: What English synonyms does 3-(3-methoxy-1,2-oxazol-5-yl)propanoic acid have? |
| A: English synonyms of 3-(3-methoxy-1,2-oxazol-5-yl)propanoic acid: 3-(3-Methoxy-1,2-oxazol-5-yl)propanoic acid, 3-(3-Methoxy-isoxazol-5-yl)-propionic acid, 3-(3-methoxy-5-isoxazolyl)propanoic acid, 3-methoxyisoxazol-5-ylpropionic acid, 3-Methoxy-5-isoxazolepropanoic acid, 3-(3-Methoxy-isoxazol-5-yl)-propionsaeure, 3-(3-methoxyisoxazol-5-yl)propanoic acid. |
| Q: What are the upstream materials of 3-(3-methoxy-1,2-oxazol-5-yl)propanoic acid? |
| A: Related upstream materials(CAS) of 3-(3-methoxy-1,2-oxazol-5-yl)propanoic acid: 67-56-1. |
| Q: What is the LogP of 3-(3-methoxy-1,2-oxazol-5-yl)propanoic acid? |
| A: LogP of 3-(3-methoxy-1,2-oxazol-5-yl)propanoic acid is 0.39. |
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. |