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线性分子式:
C2H5CH(C6H5)OH
化学文摘社编号:
分子量:
136.19
NACRES:
NA.22
PubChem Substance ID:
eCl@ss:
39023126
UNSPSC Code:
12352100
EC Number:
202-256-0
MDL number:
Beilstein/REAXYS Number:
1906759
Assay:
≥97%
InChI key
DYUQAZSOFZSPHD-UHFFFAOYSA-N
InChI
1S/C9H12O/c1-2-9(10)8-6-4-3-5-7-8/h3-7,9-10H,2H2,1H3
SMILES string
CCC(O)c1ccccc1
assay
≥97%
refractive index
n20/D 1.52 (lit.)
bp
103 °C/14 mmHg (lit.)
density
0.994 g/mL at 25 °C (lit.)
functional group
hydroxyl, phenyl
Quality Level
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General description
1-苯基-1-丙醇对映体(E-PP)形成环十肽(CDP)包合物,已利用密度泛函理论(DFT)B3LYP方法对其进行研究。它还用于确定质量转移动力学对Chiracel OB(包被在硅胶上的三苯甲酸纤维素)上1-苯基-1-丙醇(PP)对映体的洗脱曲线的影响。
signalword
Warning
hcodes
Hazard Classifications
Acute Tox. 4 Oral
存储类别
10 - Combustible liquids
wgk
WGK 3
flash_point_f
194.0 °F - closed cup
flash_point_c
90 °C - closed cup
ppe
Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
法规信息
新产品
此项目有
S Khattabi et al.
Journal of chromatography. A, 877(1-2), 95-107 (2000-06-14)
Using single-step frontal analysis, we measured single-component and competitive adsorption isotherm data for the two enantiomers of 1-phenyl-1-propanol (PP). These experimental data were fitted to several competitive bi-Langmuir models (with 8, 6, 5 and 4 parameters) and to the competitive
Enantioseparation of 1-phenyl-1-propanol by supercritical fluid-simulated moving bed chromatography.
Arvind Rajendran et al.
Journal of chromatography. A, 1092(1), 55-64 (2005-09-29)
The enantioseparation of 1-phenyl-1-propanol through the supercritical fluid-simulated moving bed (SF-SMB) process is studied. Non-linear isotherms were measured on an analytical column, and used together with the triangle theory for SMB design to select operating conditions for the SF-SMB. Experiments
Stefan Ottiger et al.
Journal of chromatography. A, 1162(1), 74-82 (2007-02-17)
The separation of the enantiomers of 1-phenyl-1-propanol by supercritical fluid chromatography on a chiral stationary phase, which consists of cellulose tris (3,5-dimethylphenylcarbamate) coated on a silica support (Chiralcel-OD), is studied under overloaded, non-linear chromatographic conditions. Pulse experiments are performed at
Hongge Zhao et al.
Journal of molecular modeling, 18(3), 851-858 (2011-06-01)
Cyclic peptides are exciting novel hosts for chiral and molecular recognition. In this work, the inclusion complexes of cyclic decapeptide (CDP) with the 1-phenyl-1-propanol enantiomers (E-PP) are firstly studied using the density functional theory (DFT) B3LYP method. Our calculated results
Pieter Saveyn et al.
Langmuir : the ACS journal of surfaces and colloids, 25(19), 11322-11327 (2009-09-03)
The influence of the physicochemical properties of the vesicular bilayer on the sorption of poorly water soluble compounds was investigated with pulsed field gradient 1H nuclear magnetic resonance (PFG-NMR) for the case of phosphatidylcholine and dioctadecyldimethylammonium bromide (DODAB), using 4-ethylbenzyl
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