About This Item
Fórmula linear:
C6H5CH2OCH2CO2H
Número CAS:
Peso molecular:
166.17
Número MDL:
Código UNSPSC:
12352100
ID de substância PubChem:
NACRES:
NA.22
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Nível de qualidade
Ensaio
95%
Formulário
liquid
índice de refração
n20/D 1.526 (lit.)
p.e.
137-139 °C/0.6 mmHg (lit.)
densidade
1.162 g/mL at 25 °C (lit.)
grupo funcional
carboxylic acid
ether
phenyl
cadeia de caracteres SMILES
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)
chave InChI
GRZHHTYDZVRPIC-UHFFFAOYSA-N
Descrição geral
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.
Aplicação
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
Outras notas
may contain chloroacetic acid
Palavra indicadora
Warning
Frases de perigo
Declarações de precaução
Classificações de perigo
Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
Órgãos-alvo
Respiratory system
Código de classe de armazenamento
10 - Combustible liquids
Classe de risco de água (WGK)
WGK 3
Ponto de fulgor (°F)
235.4 °F - closed cup
Ponto de fulgor (°C)
113 °C - closed cup
Equipamento de proteção individual
Eyeshields, Gloves, type ABEK (EN14387) respirator filter
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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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