丁基苯结构式
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常用名 | 丁基苯 | 英文名 | Butylbenzene |
|---|---|---|---|---|
| CAS号 | 104-51-8 | 分子量 | 134.21800 | |
| 密度 | 0.86 g/mL at 25 °C(lit.) | 沸点 | 183 °C(lit.) | |
| 分子式 | C10H14 | 熔点 | -88 °C | |
| MSDS | 中文版 美版 | 闪点 | 139 °F | |
| 符号 |
GHS02, GHS06, GHS08 |
信号词 | Danger |
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QSPR modeling of octanol/water partition coefficient for vitamins by optimal descriptors calculated with SMILES.
Eur. J. Med. Chem. 43 , 714-40, (2008) Simplified molecular input line entry system (SMILES) has been utilized in constructing quantitative structure-property relationships (QSPR) for octanol/water partition coefficient of vitamins and organic compounds of different classes by optimal descriptors.... |
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Evaluation of injection methods for fast, high peak capacity separations with low thermal mass gas chromatography.
J. Chromatogr. A. 1392 , 82-90, (2015) Low thermal mass gas chromatography (LTM-GC) was evaluated for rapid, high peak capacity separations with three injection methods: liquid, headspace solid phase micro-extraction (HS-SPME), and direct vapor. An Agilent LTM equipped with a short microbore capil... |
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Evaluation of detection sensitivity in comprehensive two-dimensional liquid chromatography separations of an active pharmaceutical ingredient and its degradants.
Anal. Bioanal. Chem 407(1) , 265-77, (2015) In this paper, we describe the findings of a study aimed at assessing the detection sensitivity of comprehensive two-dimensional high-performance liquid chromatography (LCxLC) separation of a degraded active pharmaceutical ingredient (API) with UV absorption ... |
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Thermal pretreatments of superficially porous silica particles for high-performance liquid chromatography: Surface control, structural characterization and chromatographic evaluation.
J. Chromatogr. A. 1419 , 45-57, (2015) This study reports the impact of thermal pretreatment between 400 and 1100°C on superficially porous silica particles (e.g. core-shell, fused-core; here abbreviated as SPP silica). The different thermally pretreated SPP silica (400°C, 900°C and 1100°C) were c... |
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Study of the potential oxidative stress induced by six solvents in the rat brain.
Neurotoxicology 35 , 71-83, (2013) The mechanisms of action involved in the neurotoxicity of solvents are poorly understood. In vitro studies have suggested that the effects of some solvents might be due to the formation of reactive oxygen species (ROS). This study assesses hydroxyl radical (O... |
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Decoys for docking.
J. Med. Chem. 48 , 3714-28, (2005) Molecular docking is widely used to predict novel lead compounds for drug discovery. Success depends on the quality of the docking scoring function, among other factors. An imperfect scoring function can mislead by predicting incorrect ligand geometries or by... |
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Predictive three-dimensional quantitative structure-activity relationship of cytochrome P450 1A2 inhibitors.
J. Med. Chem. 48 , 3808-15, (2005) The purpose of this study was to determine the cytochrome P450 1A2 (CYP1A2) inhibition potencies of structurally diverse compounds to create a comprehensive three-dimensional quantitative structure-activity relationship (3D-QSAR) model of CYP1A2 inhibitors an... |
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Development of an equilibrium headspace gas chromatographic method for the measurement of noncovalent association and partitioning of n-alkylbenzenes at infinite dilution in fulvic acid pseudophase.
J. Chromatogr. A. 1383 , 1-7, (2015) Fulvic acid (FA), the most important water soluble fraction of humic substances in nature, is known to form aggregate pseudophase and complexes with organic and inorganic species. Here, we report a novel equilibrium headspace gas chromatography (eHSGC) and a ... |
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Active flow management in preparative chromatographic separations: a preliminary investigation into enhanced separation using a curtain flow inlet fitting and segmented flow outlet fitting.
J. Sep. Sci. 35(3) , 410-5, (2012) Active flow management in the form of curtain flow sample introduction and segmented outlet flow control has been shown to enable sample to elute through a chromatography column under the principles of the "infinite diameter column". Such an elution process a... |
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Metabolites of three structural isomers of butylbenzene in the bile of rainbow trout.
Bull. Environ. Contam. Toxicol. 44(3) , 487-93, (1990)
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