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Merck

432040

Sigma-Aldrich

Benzyloxyacetic acid

95%

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About This Item

Fórmula lineal:
C6H5CH2OCH2CO2H
Número de CAS:
Peso molecular:
166.17
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22

Quality Level

assay

95%

form

liquid

refractive index

n20/D 1.526 (lit.)

bp

137-139 °C/0.6 mmHg (lit.)

density

1.162 g/mL at 25 °C (lit.)

functional group

carboxylic acid
ether
phenyl

SMILES string

OC(=O)COCc1ccccc1

InChI

1S/C9H10O3/c10-9(11)7-12-6-8-4-2-1-3-5-8/h1-5H,6-7H2,(H,10,11)

InChI key

GRZHHTYDZVRPIC-UHFFFAOYSA-N

General description

In vitro activities of phenoxy and benzyloxyacetic acid derivatives as antisickling agents has been investigated by the application of quantitative structure activity relationship (QSAR) of Hansch-type.

Application

Benzyloxyacetic acid may be used for the following syntheses:
  • mixed benzyloxyacetic pivalic anhydride
  • chiral glycolates, 1,2:4,5-di-O-isopropylidene-β-D-fructopyranos-3-yl benzyloxyacetate, via esterification
  • tetraaqua(1,10-phenanthroline-[κ]2N,N′)magnesium(II) bis[(2,4-dichlorophenyl)acetate]
  • as ligand in the preparation of diaquabis(benzyloxyacetato)copper(II) complex

Other Notes

may contain chloroacetic acid

pictograms

Exclamation mark

signalword

Warning

Hazard Classifications

Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

target_organs

Respiratory system

Storage Class

10 - Combustible liquids

wgk_germany

WGK 3

flash_point_f

235.4 °F - closed cup

flash_point_c

113 °C - closed cup

ppe

Eyeshields, Gloves, type ABEK (EN14387) respirator filter


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Visite la Librería de documentos

Xiao-Min Hao et al.
Acta crystallographica. Section E, Structure reports online, 64(Pt 8), m1052-m1052 (2008-01-01)
In the mononuclear title complex, [Mg(C(12)H(8)N(2))(H(2)O)(4)](C(8)H(5)Cl(2)O(2))(2), each Mg(II) ion is hexa-coordinated by two N atoms from a 1,10-phenanthroline ligand [Mg-N = 2.233 (2) Å] and four water mol-ecules [Mg-OW = 2.033 (2) and 2.043 (1) Å] in a distorted octa-hedral geometry. A twofold rotation axis
An inexpensive carbohydrate derivative used as a chiral auxiliary in the synthesis of a-hydroxy carboxylic acids.
Yu H, et al.
Tetrahedron, 58(38), 7663-7669 (2002)
Diaquabis (benzyloxyacetato) copper (II).
Sun S-L, et al.
Acta Crystallographica Section E, Structure Reports Online, 64(5), 1052-1052 (2008)
M A Mahran
Bollettino chimico farmaceutico, 139(2), 73-80 (2000-08-02)
Quantitative structure activity relationship of Hansch-type has been applied to develop correlation between the calculated physicochemical properties and the in vitro activities of phenoxy and benzyloxyacetic acid derivatives as antisickling agents. The antisickling effect of these compounds was first reported
A highly effective asymmetric synthesis of a-hydroxy acids by alkylation of chiral n-(benzyloxyacetyl)-trans-2, 5-bis (methoxymethoxymethyl) pyrrolidine.
Enomoto M, et al.
Tetrahedron Letters, 26(10), 1343-1344 (1985)

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