(4-bromophenyl) 2,2-dimethylpropanoate结构式
|
常用名 | (4-bromophenyl) 2,2-dimethylpropanoate | 英文名 | (4-bromophenyl) 2,2-dimethylpropanoate |
|---|---|---|---|---|
| CAS号 | 63549-55-3 | 分子量 | 257.12400 | |
| 密度 | 1.333g/cm3 | 沸点 | 288.1ºC at 760 mmHg | |
| 分子式 | C11H13BrO2 | 熔点 | N/A | |
| MSDS | N/A | 闪点 | 128.1ºC |
摘要:(4-溴苯基)2,2-二甲基丙酸酯,中文名称未提供,CAS号为63549-55-3,分子式C11H13BrO2,分子量257.12400,密度1.333g/cm³,沸点288.1ºC。仅供科研实验参考,不作为医疗诊断与用药依据。
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 | (4-bromophenyl) 2,2-dimethylpropanoate |
|---|---|
| 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。
| 密度 | 1.333g/cm3 |
|---|---|
| 沸点 | 288.1ºC at 760 mmHg |
| 分子式 | C11H13BrO2 |
| 分子量 | 257.12400 |
| 闪点 | 128.1ºC |
| 精确质量 | 256.01000 |
| PSA | 26.30000 |
| LogP | 3.40060 |
| InChIKey | AOFCPDLMHXFUHE-UHFFFAOYSA-N |
| SMILES | CC(C)(C)C(=O)Oc1ccc(Br)cc1 |
| 折射率 | 1.525 |
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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~69%
(4-bromophenyl)... 63549-55-3 |
| 文献:Tobisu, Mamoru; Yamakawa, Ken; Shimasaki, Toshiaki; Chatani, Naoto Chemical Communications, 2011 , vol. 47, # 10 p. 2946 - 2948 |
|
~95%
(4-bromophenyl)... 63549-55-3 |
| 文献:Lohre, Claudia; Droege, Thomas; Wang, Congyang; Glorius, Frank Chemistry - A European Journal, 2011 , vol. 17, # 22 p. 6052 - 6055 |
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~%
(4-bromophenyl)... 63549-55-3 |
| 文献:Tobisu, Mamoru; Yamakawa, Ken; Shimasaki, Toshiaki; Chatani, Naoto Chemical Communications, 2011 , vol. 47, # 10 p. 2946 - 2948 |
|
~%
(4-bromophenyl)... 63549-55-3 |
| 文献:Piller, Fabian M.; Metzger, Albrecht; Schade, Matthias A.; Haag, Benjamin A.; Gavryushin, Andrei; Knochel, Paul Chemistry - A European Journal, 2009 , vol. 15, # 29 p. 7192 - 7202 |
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~0%
(4-bromophenyl)... 63549-55-3 |
| 文献:Piller, Fabian M.; Metzger, Albrecht; Schade, Matthias A.; Haag, Benjamin A.; Gavryushin, Andrei; Knochel, Paul Chemistry - A European Journal, 2009 , vol. 15, # 29 p. 7192 - 7202 |
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。
| (4-bromophenyl) 2,2-dimethylpropanoate上游产品 5 | |
|---|---|
| (4-bromophenyl) 2,2-dimethylpropanoate下游产品 2 | |
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:Discovery of Small Molecules to Inhibit Human Cytomegalovirus Nuclear Egress
来源:ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
靶标:HCMV UL50
External Id:HMS1262
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实验名称:Screen for inhibitors of RMI FANCM (MM2) intereaction
来源:11908
靶标:N/A
External Id:RMI-FANCM-MM2
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实验名称:Chemical Probes of Kaposi's Sarcoma Herpes Virus Latent Infection
来源:ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
靶标:ORF 73 [Human herpesvirus 8 type M]
External Id:HMS791
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实验名称:High-throughput screen for inhibitors of the GIV GBA-motif interaction with Galpha-i ...
来源:ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
External Id:HMS1303
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实验名称:A screen for compounds that inhibit the activity of LtaS in Staphylococcus aureus
来源:ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
External Id:HMS979
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实验名称:Alphascreen assay for small molecules abrogating mHTT-CaM Interaction
来源:24983
靶标:Huntingtin
External Id:KUHTS-Muma KU-CaM-Htt INH-01
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实验名称:Cell-based high throughput primary assay to identify activators of GPR151
来源:The Scripps Research Institute Molecular Screening Center
靶标:RecName: Full=G-protein coupled receptor 151; AltName: Full=G-protein coupled receptor PGR7; AltName: Full=GPCR-2037; AltName: Full=Galanin receptor 4; AltName: Full=Galanin-receptor-like protein; Short=GalRL
External Id:GPR151_PHUNTER_AG_LUMI_1536_1X%ACT
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实验名称:AlphaScreen-based biochemical high throughput primary assay to identify activators of...
来源:The Scripps Research Institute Molecular Screening Center
靶标:N/A
External Id:FBW7_ACT_ALPHA_1536_1X%ACT PRUN
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实验名称:AlphaScreen-based biochemical high throughput primary assay to identify inhibitors of...
来源:The Scripps Research Institute Molecular Screening Center
External Id:MITF_INH_Alpha_1536_1X%INH PRUN
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实验名称:Discovering small molecule activators of G protein-gated inwardly-rectifying potassiu...
来源:15621
靶标:G protein-activated inward rectifier potassium channel 2
External Id:VANDERBILT_HTS_GIRK2_MPD
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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。
| 4-bromophenyl 2,2-dimethylpropanoate |
| HMS1594A02 |
| 4-bromophenylpivalate |
| F3098-7605 |
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: 63549-55-3的极性表面积PSA是多少? |
| A: 63549-55-3极性表面积PSA为26.30000。 |
| Q: 63549-55-3的中文名称是什么? |
| A: 63549-55-3的中文名称为63549-55-3。 |
| Q: 63549-55-3的分子式是什么? |
| A: 63549-55-3分子式为C11H13BrO2。 |
| Q: 63549-55-3有哪些英文别名? |
| A: 63549-55-3英文别名有:4-bromophenyl 2,2-dimethylpropanoate、 HMS1594A02、 4-bromophenylpivalate、 F3098-7605。 |
| Q: 63549-55-3的CAS号是多少? |
| A: 63549-55-3CAS号为63549-55-3。 |
| Q: 63549-55-3的下游产品有哪些? |
| A: 63549-55-3相关下游产品(CAS):5471-51-2;4920-92-7。 |
| Q: 63549-55-3的LogP(油水分配系数)是多少? |
| A: 63549-55-3LogP(油水分配系数)为3.40060。 |
| Q: 63549-55-3的分子量是多少? |
| A: 63549-55-3分子量为257.12400。 |
| Q: 63549-55-3的SMILES表达式是什么? |
| A: 63549-55-3SMILES表达式为CC(C)(C)C(=O)Oc1ccc(Br)cc1。 |
| Q: 63549-55-3的英文名称是什么? |
| A: 63549-55-3英文名称为(4-bromophenyl) 2,2-dimethylpropanoate。 |