methyl 4-(2-methoxy-2-oxoethoxy)benzoate结构式
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常用名 | methyl 4-(2-methoxy-2-oxoethoxy)benzoate | 英文名 | methyl 4-(2-methoxy-2-oxoethoxy)benzoate |
|---|---|---|---|---|
| CAS号 | 35005-30-2 | 分子量 | 224.21000 | |
| 密度 | N/A | 沸点 | N/A | |
| 分子式 | C11H12O5 | 熔点 | N/A | |
| MSDS | N/A | 闪点 | N/A |
本表展示该化学物质的中文名称、英文系统名、各类中文与英文别名信息。
| 英文名 | methyl 4-(2-methoxy-2-oxoethoxy)benzoate |
|---|---|
| 英文别名 | 更多 |
本表包含该物质理化参数,如熔点、沸点、密度、溶解度、旋光性等理化指标,无数据项标记为N/A。
| 分子式 | C11H12O5 |
|---|---|
| 分子量 | 224.21000 |
| 精确质量 | 224.06800 |
| PSA | 61.83000 |
| LogP | 1.02500 |
| InChIKey | KNKLWCHCJYAQKD-UHFFFAOYSA-N |
| SMILES | COC(=O)COc1ccc(C(=O)OC)cc1 |
本表提供该化合物公开报道的合成路线、反应条件、反应物与产物参考信息。
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~70%
methyl 4-(2-met... 35005-30-2 |
| 文献:BEZWADA BIOMEDICAL, LLC Patent: US2009/170927 A1, 2009 ; Location in patent: Page/Page column 14 ; |
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~68%
methyl 4-(2-met... 35005-30-2 |
| 文献:Lyakhov; Lyakhova; Panchenko; Litvinova; Andronati Pharmaceutical Chemistry Journal, 2001 , vol. 35, # 12 p. 653 - 656 |
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~7%
methyl 4-(2-met... 35005-30-2 |
| 文献:Banerjee, Amalendu; Adak, Mohini Mohan; Das, Sankar; Banerjee, Santa; Sengupta, Saumitra Journal of the Indian Chemical Society, 1987 , vol. 64, # 1 p. 34 - 37 |
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~95%
methyl 4-(2-met... 35005-30-2 |
| 文献:Banerjee, Amalendu; Adak, Mohini Mohan; Das, Sankar; Banerjee, Santa; Sengupta, Saumitra Journal of the Indian Chemical Society, 1987 , vol. 64, # 1 p. 34 - 37 |
本表列出该化学品对应的上游起始原料以及下游衍生产物清单。
| methyl 4-(2-methoxy-2-oxoethoxy)benzoate上游产品 5 | |
|---|---|
| methyl 4-(2-methoxy-2-oxoethoxy)benzoate下游产品 3 | |
本表记录该化合物靶点、体外体内实验、生物测定实验相关实验数据。
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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:Primary Screen Inhibitors of CD40 Signaling in BL2 Cells Measured in Cell-Based Syste...
来源:Broad Institute
靶标:N/A
External Id:7124-01_Inhibitor_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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本表罗列该化合物全部英文别名、系统命名、CAS别名等英文名称集合。
| HMS2361C12 |
| methyl 4-carbomethoxyphenoxyacetate |
| 4-Methoxycarbonylmethoxy-benzoesaeure-methylester |
| 4-Carbomethoxy-phenoxyessigsaeure-methylester |
| 4-Methoxycarbonylmethoxy-benzoic acid methyl ester |
本部分为该化合物相关常见问答,包含基础参数、性状、储存条件等高频咨询问题与对应答案。
| Q: 35005-30-2的SMILES表达式是什么? |
| A: 35005-30-2SMILES表达式为COC(=O)COc1ccc(C(=O)OC)cc1。 |
| Q: 35005-30-2的分子量是多少? |
| A: 35005-30-2分子量为224.21000。 |
| Q: 35005-30-2的下游产品有哪些? |
| A: 35005-30-2相关下游产品(CAS):19360-67-9;202195-67-3;83785-14-2。 |
| Q: 35005-30-2的上游原料有哪些? |
| A: 35005-30-2相关上游原料(CAS):96-34-4;99-76-3;96-32-2;67-56-1;19360-67-9。 |
| Q: 35005-30-2有哪些英文别名? |
| A: 35005-30-2英文别名有:HMS2361C12、 methyl 4-carbomethoxyphenoxyacetate、 4-Methoxycarbonylmethoxy-benzoesaeure-methylester、 4-Carbomethoxy-phenoxyessigsaeure-methylester、 4-Methoxycarbonylmethoxy-benzoic acid methyl ester。 |
| Q: 35005-30-2的InChIKey是什么? |
| A: 35005-30-2InChIKey为KNKLWCHCJYAQKD-UHFFFAOYSA-N。 |
| Q: 35005-30-2的英文名称是什么? |
| A: 35005-30-2英文名称为methyl 4-(2-methoxy-2-oxoethoxy)benzoate。 |
| Q: 35005-30-2的CAS号是多少? |
| A: 35005-30-2CAS号为35005-30-2。 |
| Q: 35005-30-2的中文名称是什么? |
| A: 35005-30-2的中文名称为35005-30-2。 |
| Q: 35005-30-2的LogP(油水分配系数)是多少? |
| A: 35005-30-2LogP(油水分配系数)为1.02500。 |
本表列出该化合物相关生产厂商、供应商信息,包含厂家名称、产品供应相关参考信息。
| 上海化源世纪贸易有限公司 |