3-吗啉-4-基-丙酸盐酸盐结构式
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常用名 | 3-吗啉-4-基-丙酸盐酸盐 | 英文名 | 3-(Morpholin-4-yl)propionic acid hydrochloride |
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| CAS号 | 6319-95-5 | 分子量 | 195.644 | |
| 密度 | N/A | 沸点 | 299.2ºC at 760 mmHg | |
| 分子式 | C7H14ClNO3 | 熔点 | N/A | |
| MSDS | N/A | 闪点 | 134.8ºC |
| 中文名 | 3-(吗啉-4-基)丙酸盐酸盐 |
|---|---|
| 英文名 | 3-morpholin-4-ylpropanoic acid,hydrochloride |
| 中文别名 | 3-吗啉-4-丙酸 |
| 英文别名 | 更多 |
| 沸点 | 299.2ºC at 760 mmHg |
|---|---|
| 分子式 | C7H14ClNO3 |
| 分子量 | 195.644 |
| 闪点 | 134.8ºC |
| 精确质量 | 195.066223 |
| PSA | 49.77000 |
| LogP | 0.53320 |
| InChIKey | JLAHMPKUDAJSKA-UHFFFAOYSA-N |
| SMILES | Cl.O=C(O)CCN1CCOCC1 |
| 储存条件 | 室温 |
| 分子结构 | 1、 摩尔折射率:39.14 2、 摩尔体积(cm3/mol):137.2 3、 等张比容(90.2K):349.6 4、 表面张力(dyne/cm):42.0 5、 极化率(10-24cm3):15.51 |
| 计算化学 | 1.疏水参数计算参考值(XlogP):无 2.氢键供体数量:2 3.氢键受体数量:4 4.可旋转化学键数量:3 5.互变异构体数量:无 6.拓扑分子极性表面积49.8 7.重原子数量:12 8.表面电荷:0 9.复杂度:132 10.同位素原子数量:0 11.确定原子立构中心数量:0 12.不确定原子立构中心数量:0 13.确定化学键立构中心数量:0 14.不确定化学键立构中心数量:0 15.共价键单元数量:2 |
| 更多 | 1.熔点(760 mmHg,ºC):215 - 217 |
| 危害码 (欧洲) | Xi |
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3-吗啉-4-基-丙酸盐酸盐 6319-95-5 |
| 文献:Journal of Molecular Structure, , vol. 560, # 1-3 p. 261 - 273 |
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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: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:Absorbance-based primary biochemical high throughput screening assay to identify acti...
来源:The Scripps Research Institute Molecular Screening Center
靶标:caspase-3 preproprotein [Homo sapiens]
External Id:PROCASPASE3_ACT_EPIABS_1536_1X%ACT PRUN
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| 3-morpholino-propionic acid,hydrochloride |
| 3-(4-Morpholinyl)propanoic acid hydrochloride (1:1) |
| 3-(Morpholin-4-yl)propanoic acid hydrochloride (1:1) |
| 3-Morpholino-propionsaeure,Hydrochlorid |
| 4-Morpholinepropanoic acid, hydrochloride (1:1) |
| 3-Morpholin-4-Yl-Propionic Acid Hydrochloride |
| 3-Morpholinopropanoic acid hydrochloride |