279897
(R)-(-)-2-苯基丙酸
97%
别名:
(R)-(-)-氢化阿托酸, (R)-HTA
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关于此项目
线性分子式:
CH3CH(C6H5)CO2H
化学文摘社编号:
分子量:
150.17
Beilstein:
2207688
MDL编号:
UNSPSC代码:
12352002
PubChem化学物质编号:
NACRES:
NA.22
方案
97%
表单
solid
旋光性
[α]20/D −72°, c = 1.6 in chloroform
光学纯度
ee: 98% (HPLC)
折射率
n20/D 1.523 (lit.)
沸点
115 °C/1 mmHg (lit.)
mp
29-30 °C (lit.)
密度
1.1 g/mL at 25 °C (lit.)
SMILES字符串
C[C@@H](C(O)=O)c1ccccc1
InChI
1S/C9H10O2/c1-7(9(10)11)8-5-3-2-4-6-8/h2-7H,1H3,(H,10,11)/t7-/m1/s1
InChI key
YPGCWEMNNLXISK-SSDOTTSWSA-N
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应用
手性结构单元。拆分剂
包装
Bottomless glass bottle. Contents are inside inserted fused cone.
警示用语：
Warning
危险声明
危险分类
Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
靶器官
Respiratory system
储存分类代码
11 - Combustible Solids
WGK
WGK 3
闪点(°F)
230.0 °F - closed cup
闪点(°C)
110 °C - closed cup
个人防护装备
dust mask type N95 (US), Eyeshields, Gloves
法规信息
新产品
此项目有
Christiane Kiske et al.
Journal of agricultural and food chemistry, 67(4), 1187-1196 (2019-01-04)
The enantiomers of a homologous series (C6-C10) of 2-mercapto-4-alkanones were obtained by lipase-catalyzed kinetic resolution of the corresponding racemic 2-acetylthio-4-alkanones. Their configurations were assigned via vibrational circular dichroism and 1H NMR anisotropy based methods. Odor thresholds and odor qualities were
Y Nakamura et al.
Drug metabolism and disposition: the biological fate of chemicals, 15(4), 529-534 (1987-07-01)
Optical isomerization of 2-phenylpropionic acid (hydratropic acid, HTA) was studied in the organs of male rat in vitro. (R)-(-)-HTA was not isomerized by rat liver homogenate even after the addition of CoA, ATP, and Mg2+ to the incubation mixture; however
Chunze Li et al.
Chemical research in toxicology, 15(11), 1480-1487 (2002-11-20)
A series of studies was conducted to investigate the potential of (R)- and (S)-2-phenylpropionic acid (2-PPA) to undergo enantioselective covalent binding to protein in freshly isolated rat hepatocytes and to determine whether such covalent binding is dependent on acyl glucuronidation
Chunze Li et al.
The Journal of pharmacology and experimental therapeutics, 305(1), 250-256 (2003-03-22)
Two alternative metabolic pathways, acyl glucuronidation and acyl-CoA formation, are implicated in the generation of reactive acylating metabolites of carboxylic acids. Here, we describe studies that determine the relative importance of these two pathways in the metabolic activation of a
Y S He et al.
Yao xue xue bao = Acta pharmaceutica Sinica, 28(12), 893-898 (1993-01-01)
The circadian rhythms of hydratropic acid (HTA) pharmacokinetic parameters were studied by using consinor method. Under standard light-dark cycle, the T1/2 beta and CL of S(+)-HTA, T1/2 beta of R(-)-HTA and CL, MRT of RS (+/-)-HTA were found to have
Chromatograms
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