6,7-dihydrocycloheptacenaphthene-5,8-dione结构式
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常用名 | 6,7-dihydrocycloheptacenaphthene-5,8-dione | 英文名 | 6,7-dihydrocycloheptacenaphthene-5,8-dione |
|---|---|---|---|---|
| CAS号 | 6345-20-6 | 分子量 | 236.26500 | |
| 密度 | N/A | 沸点 | N/A | |
| 分子式 | C16H12O2 | 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 | 6,7-dihydrocycloheptacenaphthene-5,8-dione |
|---|---|
| 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 | C16H12O2 |
|---|---|
| 分子量 | 236.26500 |
| 精确质量 | 236.08400 |
| PSA | 34.14000 |
| LogP | 3.09760 |
| InChIKey | DFUIWOPEWSENML-UHFFFAOYSA-N |
| SMILES | O=C1CCC(=O)c2ccc3c4c(ccc1c24)CC3 |
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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6,7-dihydrocycl... 6345-20-6 |
| 文献:Gen. Aniline Works Patent: US1759111 , 1927 ; Full Text Show Details I.G. Farbenind. Patent: DE542618 , 1926 ; Fortschr. Teerfarbenfabr. Verw. Industriezweige, vol. 18, p. 621 Full Text Show Details Fieser; Peters Journal of the American Chemical Society, 1932 , vol. 54, p. 4347,4355 |
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~%
6,7-dihydrocycl... 6345-20-6 |
| 文献:Fieser; Peters Journal of the American Chemical Society, 1932 , vol. 54, p. 4347,4355 |
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~%
6,7-dihydrocycl... 6345-20-6 |
| 文献:Gen. Aniline Works Patent: US1759111 , 1927 ; Full Text Show Details I.G. Farbenind. Patent: DE542618 , 1926 ; Fortschr. Teerfarbenfabr. Verw. Industriezweige, vol. 18, p. 621 |
|
~%
6,7-dihydrocycl... 6345-20-6 |
| 文献:Fieser; Peters Journal of the American Chemical Society, 1932 , vol. 54, p. 4347,4355 |
|
~%
6,7-dihydrocycl... 6345-20-6 |
| 文献:Fieser; Peters Journal of the American Chemical Society, 1932 , vol. 54, p. 4347,4355 |
|
~%
6,7-dihydrocycl... 6345-20-6 |
| 文献:Gen. Aniline Works Patent: US1759111 , 1927 ; Full Text Show Details I.G. Farbenind. Patent: DE542618 , 1926 ; Fortschr. Teerfarbenfabr. Verw. Industriezweige, vol. 18, p. 621 |
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。
| 上游产品 5 | |
|---|---|
| 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: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: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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实验名称:uHTS identification of small molecule modulators of NR3A
来源:Burnham Center for Chemical Genomics
靶标:N/A
External Id:SBCCG-A1015-NR3A-Primary-Assay
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实验名称:uHTS identification of small molecule modulators of Rev-erb Alpha.
来源:Burnham Center for Chemical Genomics
靶标:N/A
External Id:SBCCG-A1016-RevErbaLBD-Primary-Assay
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实验名称:MITF Measured in Cell-Based System Using Plate Reader - 2084-01_Activator_SinglePoint...
来源:Broad Institute
靶标:N/A
External Id:2084-01_Activator_SinglePoint_HTS_Activity
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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。
| 7-Theophyllinessigsaeure |
| 1,2,6,7-Tetrahydro-cyclohept[fg]acenaphthylen-5,8-dion |
| 7-Theophyllinylacetic acid |
| 7-theophyllineacetic acid |
| 2-(1,3-dimethyl-2,6-dioxo-2,3-dihydro-1H-purine-7(6H)-yl)acetic acid |
| 7-Theophyllinylessigsaeure |
| Carboxymethyltheophylline |
| Acefylline |
| 1,2,6,7-tetrahydro-cyclohept[fg]acenaphthylene-5,8-dione |
| Theophyllineacetic acid |
| 7-(Carboxymethyl)theophylline |
| 1,3-dimethyl-7-(2-carboxyethyl)xanthine |
| Acepleiadandion |
| Acephylline |
| Theophylline-7-acetic acid |
| 1,3-dimethylxanthine-7-acetic acid |
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: 6345-20-6的上游原料有哪些? |
| A: 6345-20-6相关上游原料(CAS):108-30-5;83-32-9;7504-38-3;16294-60-3;7446-70-0。 |
| Q: 6345-20-6的下游产品有哪些? |
| A: 6345-20-6相关下游产品(CAS):128-97-2;518-02-5。 |
| Q: 6345-20-6的CAS号是多少? |
| A: 6345-20-6CAS号为6345-20-6。 |
| Q: 6345-20-6的LogP(油水分配系数)是多少? |
| A: 6345-20-6LogP(油水分配系数)为3.09760。 |
| Q: 6345-20-6的极性表面积PSA是多少? |
| A: 6345-20-6极性表面积PSA为34.14000。 |
| Q: 6345-20-6的分子量是多少? |
| A: 6345-20-6分子量为236.26500。 |
| Q: 6345-20-6的分子式是什么? |
| A: 6345-20-6分子式为C16H12O2。 |
| Q: 6345-20-6的InChIKey是什么? |
| A: 6345-20-6InChIKey为DFUIWOPEWSENML-UHFFFAOYSA-N。 |
| Q: 6345-20-6的中文名称是什么? |
| A: 6345-20-6的中文名称为6345-20-6。 |
| Q: 6345-20-6的SMILES表达式是什么? |
| A: 6345-20-6SMILES表达式为O=C1CCC(=O)c2ccc3c4c(ccc1c24)CC3。 |