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About This Item
Linear Formula:
C6H5OCH(CH3)CO2H
CAS Number:
Molecular Weight:
166.17
Beilstein:
5734971
EC Number:
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22
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Quality Level
Assay
≥98%
bp
265 °C (lit.)
mp
112-115 °C (lit.)
functional group
carboxylic acid
phenoxy
SMILES string
CC(Oc1ccccc1)C(O)=O
InChI
1S/C9H10O3/c1-7(9(10)11)12-8-5-3-2-4-6-8/h2-7H,1H3,(H,10,11)
InChI key
SXERGJJQSKIUIC-UHFFFAOYSA-N
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General description
Solvent-induced invesrsion of enantioselectivity during esterification of 2-phenoxypropionic acid catalyzed by Candida cylindracea lipase has been investigated. Derivatives of 2-phenoxypropionic acid are potential herbicides.
Storage Class Code
11 - Combustible Solids
WGK
WGK 1
Flash Point(F)
Not applicable
Flash Point(C)
Not applicable
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Manuel A P Segurado et al.
The Journal of organic chemistry, 72(14), 5327-5336 (2007-06-15)
Rate constants were measured for the oxidative chlorodehydrogenation of (R,S)-2-phenoxypropanoic acid and nine ortho-, ten para- and five meta-substituted derivatives using (R,S)-1-chloro-3-methyl-2,6-diphenylpiperidin-4-one (NCP) as chlorinating agent. The kinetics was run in 50% (v/v) aqueous acetic acid acidified with perchloric acid
Lipase-catalyzed production of optically active acids via asymmetric hydrolysis of esters.
Cambou B and Klibanov AM.
Applied Biochemistry and Biotechnology, 9(3), 255-260 (1984)
Solvent-induced inversion of enantiosflectivity in lipase-catalyzed esterification of 2-phenoxypropionic acids.
Ueji S, et al.
Biotechnology Letters, 14(3), 163-168 (1992)
Yan He et al.
Journal of pharmaceutical sciences, 95(1), 97-107 (2005-11-30)
The efficiency of a solubilization technique is determined by the physical-chemical properties of the drug. This study investigates the solubilization on two structurally related anticancer drugs, XK-469 and PPA. XK-469 is much less polar than PPA with an intrinsic solubility
Jessica Lin et al.
Journal of chromatography. A, 1624, 461244-461244 (2020-06-17)
Analysis and control of stereoisomers is a major task in pharmaceutical analysis, and is a greater challenge when compounds with multiple chiral centers (MCC) are concerned. HPLC and SFC are commonly used for stereoisomer analysis in drug development, typically starting
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