5-甲基-3-苯基-4-异恶唑甲酸甲酯结构式
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常用名 | 5-甲基-3-苯基-4-异恶唑甲酸甲酯 | 英文名 | 4-ISOXAZOLECARBOXYLIC ACID, 5-METHYL-3-PHENYL-, METHYL ESTER |
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| CAS号 | 2065-28-3 | 分子量 | 217.221 | |
| 密度 | 1.2±0.1 g/cm3 | 沸点 | 361.0±30.0 °C at 760 mmHg | |
| 分子式 | C12H11NO3 | 熔点 | 79-81ºC | |
| MSDS | N/A | 闪点 | 172.1±24.6 °C |
| 中文名 | 5-甲基-3-苯基-4-异噁唑羧酸甲酯 |
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| 英文名 | methyl 5-methyl-3-phenyl-1,2-oxazole-4-carboxylate |
| 英文别名 | 更多 |
| 密度 | 1.2±0.1 g/cm3 |
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| 沸点 | 361.0±30.0 °C at 760 mmHg |
| 熔点 | 79-81ºC |
| 分子式 | C12H11NO3 |
| 分子量 | 217.221 |
| 闪点 | 172.1±24.6 °C |
| 精确质量 | 217.073898 |
| PSA | 52.33000 |
| LogP | 1.82 |
| InChIKey | VJCQAWFSNYNJLG-UHFFFAOYSA-N |
| SMILES | COC(=O)c1c(-c2ccccc2)noc1C |
| 蒸汽压 | 0.0±0.8 mmHg at 25°C |
| 折射率 | 1.538 |
| 储存条件 | 室温 |
| 海关编码 | 2934999090 |
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~39%
5-甲基-3-苯基-4-异恶唑甲酸甲酯 2065-28-3 |
| 文献:Green, Jeremy; Bemis, Guy; Grillot, Anne-Laure; Ledeboer, Mark; Salituro, Francesco G.; Harrington, Edmund; Gao, Huai; Baker, Christopher; Cao, Jingrong; Hale, Michael Patent: US2003/149051 A1, 2003 ; |
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~83%
5-甲基-3-苯基-4-异恶唑甲酸甲酯 2065-28-3 |
| 文献:Kijima, Masashi; Nambu, Yoko; Endo, Takeshi Journal of Organic Chemistry, 1985 , vol. 50, # 7 p. 1140 - 1142 |
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~65%
5-甲基-3-苯基-4-异恶唑甲酸甲酯 2065-28-3 |
| 文献:Lasri, Jamal; Mukhopadhyay, Suman; Charmier, M. Adilia Januario Journal of Heterocyclic Chemistry, 2008 , vol. 45, # 5 p. 1385 - 1389 |
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5-甲基-3-苯基-4-异恶唑甲酸甲酯 2065-28-3 |
| 文献:Synthesis, , # 9 p. 1347 - 1356 |
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5-甲基-3-苯基-4-异恶唑甲酸甲酯 2065-28-3 |
| 文献:Journal of Heterocyclic Chemistry, , vol. 49, # 3 p. 621 - 627 |
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5-甲基-3-苯基-4-异恶唑甲酸甲酯 2065-28-3 |
| 文献:Journal of Heterocyclic Chemistry, , vol. 49, # 3 p. 621 - 627 |
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5-甲基-3-苯基-4-异恶唑甲酸甲酯 2065-28-3 |
| 文献:Chemische Berichte, , vol. 106, p. 3275 - 3290 |
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5-甲基-3-苯基-4-异恶唑甲酸甲酯 2065-28-3
详细
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文献:Bulletin de la Societe Chimique de France, , vol. |
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5-甲基-3-苯基-4-异恶唑甲酸甲酯 2065-28-3 |
| 文献:Pharmaceutical Chemistry Journal, , # 11 p. 633 - 634 Khimiko-Farmatsevticheskii Zhurnal, , # 11 p. 29 - 31 |
| 5-甲基-3-苯基-4-异恶唑甲酸甲酯上游产品 10 | |
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| 5-甲基-3-苯基-4-异恶唑甲酸甲酯下游产品 5 | |
| 海关编码 | 2934999090 |
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| 中文概述 | 2934999090. 其他杂环化合物. 增值税率:17.0%. 退税率:13.0%. 监管条件:无. 最惠国关税:6.5%. 普通关税:20.0% |
| 申报要素 | 品名, 成分含量, 用途 |
| Summary | 2934999090. other heterocyclic compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0% |
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实验名称:Primary cell-based high-throughput screening assay for identification of compounds th...
来源:Johns Hopkins Ion Channel Center
靶标:regulator of G-protein signaling 4 isoform 2 [Homo sapiens]
External Id:JHICC_RGS_Act_HTS
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实验名称:Luminescence-based cell-based primary high throughput screening assay to identify ago...
来源:The Scripps Research Institute Molecular Screening Center
靶标:mu-type opioid receptor isoform MOR-1 [Homo sapiens]
External Id:OPRM1-OPRD1_AG_LUMI_1536_1X%ACT PRUN
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实验名称:QFRET-based biochemical primary high throughput screening assay to identify exosite i...
来源:The Scripps Research Institute Molecular Screening Center
靶标:disintegrin and metalloproteinase domain-containing protein 17 preproprotein [Homo sapiens]
External Id:ADAM17_INH_QFRET_1536_1X%INH PRUN
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实验名称:Fluorescence-based cell-based primary high throughput screening assay to identify ago...
来源:The Scripps Research Institute Molecular Screening Center
靶标:muscarinic acetylcholine receptor M1 [Homo sapiens]
External Id:CHRM1_AG_FLUO8_1536_1X%ACT PRUN
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实验名称:uHTS identification of small molecule activators of the adaptive arm of the Unfolded ...
来源:Burnham Center for Chemical Genomics
靶标:N/A
External Id:BCCG-A405-UPR-XBP1-PrimaryAgonist-Assay
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实验名称:High throughput fluorescence intensity-based biochemical assay to screen for small mo...
来源:University of Pittsburgh Molecular Library Screening Center
靶标: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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实验名称:Fluorescence polarization to screen for inhibitor that competite the binding of FadD2...
来源:Broad Institute
靶标:FATTY-ACID-CoA LIGASE FADD28 (FATTY-ACID-CoA SYNTHETASE)
External Id:2147-01_Inhibitor_SinglePoint_HTS_Activity
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实验名称:Bursicon-induced LGR2 mediated cAMP production in LGR-2/CRE6x-Luciferase co-transfect...
来源:Broad Institute
靶标: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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实验名称:Fluorescence-based cell-based primary high throughput screening assay to identify pos...
来源:The Scripps Research Institute Molecular Screening Center
靶标:muscarinic acetylcholine receptor M1 [Homo sapiens]
External Id:CHRM1_PAM_FLUO8_1536_1X%ACT PRUN
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实验名称:Fluorescence polarization-based biochemical high throughput primary assay to identify...
来源:The Scripps Research Institute Molecular Screening Center
靶标: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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| 4-Isoxazolecarboxylic acid, 5-methyl-3-phenyl-, methyl ester |
| 3-Phenyl-5-methyl-4-isoxazol-carbonsaeure-methylester |
| methyl 5-methyl-3-phenylisoxazole-4-carboxylate |
| 5-Methyl-3-Phenyl-4-isoxazol-carbonsaeure-methylester |
| Methyl 5-methyl-3-phenyl-1,2-oxazole-4-carboxylate |
| methyl 5-methyl-3-phenyl-4-isoxazolecarboxylate |
| 5-Methyl-3-phenyl-isoxazole-4-carboxylic acid methyl ester |
| 3-Phenyl-5-methyl-isoxazol-4-carbonsaeure-methylester |