Merck
CN

330884

Sigma-Aldrich

(R)-(+)-阿替洛尔

99%

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别名:
(+)-4-[2-羟基-3-[(1-甲基乙基)氨基]丙氧基]苯乙酰胺
线性分子式:
(CH3)2CHNHCH2CH(OH)CH2OC6H4CH2CONH2
CAS号:
分子量:
266.34
MDL编号:
PubChem化学物质编号:
NACRES:
NA.22

质量水平

检测方案

99%

旋光性

[α]25/D +16°, c = 1 in 1 M HCl

mp

148-152 °C (lit.)

SMILES字符串

CC(C)NC[C@@H](O)COc1ccc(CC(N)=O)cc1

InChI

1S/C14H22N2O3/c1-10(2)16-8-12(17)9-19-13-5-3-11(4-6-13)7-14(15)18/h3-6,10,12,16-17H,7-9H2,1-2H3,(H2,15,18)/t12-/m1/s1

InChI key

METKIMKYRPQLGS-GFCCVEGCSA-N

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储存分类代码

11 - Combustible Solids

WGK

WGK 3

闪点(°F)

Not applicable

闪点(°C)

Not applicable

个人防护装备

Eyeshields, Gloves, type N95 (US)

法规信息

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Kinetic resolution of (R,S)-atenolol is a faster strategy to produce (S)-atenolol. Since this racemate is a less soluble compound, resolution of its ester offers high concentrations in the process. A good analytical method is required to observe the enantiomer concentrations.
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As the (R)-enantiomer of racemic atenolol has no β-blocking activity and no lack of side effects, switching from the racemate to the (S)-atenolol is more favorable. Transesterification of racemic atenolol using free enzymes investigated as a resource to resolve the
Kevin F Morris et al.
Chemical physics, 457, 133-146 (2015-08-11)
Molecular dynamics simulations and NMR spectroscopy were used to compare the binding of two β-blocker drugs to the chiral molecular micelle poly-(sodium undecyl-(L)-leucine-valine). The molecular micelle is used as a chiral selector in capillary electrophoresis. This study is part of
Ulisse Garbin et al.
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