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About This Item
线性分子式:
CH3CH(OH)CH2CO2CH3
CAS号:
分子量:
118.13
Beilstein:
6367546
EC 号:
MDL编号:
UNSPSC代码:
12352108
PubChem化学物质编号:
NACRES:
NA.22
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质量水平
方案
99%
表单
liquid
旋光性
[α]20/D +19.8°, neat
光学纯度
ee: 98% (GLC)
折射率
n20/D 1.421 (lit.)
沸点
63 °C/10 mmHg (lit.)
密度
1.071 g/mL at 25 °C (lit.)
官能团
ester
hydroxyl
SMILES字符串
COC(=O)C[C@H](C)O
InChI
1S/C5H10O3/c1-4(6)3-5(7)8-2/h4,6H,3H2,1-2H3/t4-/m0/s1
InChI key
LDLDJEAVRNAEBW-BYPYZUCNSA-N
应用
Methyl (S)-(+)-3-hydroxybutyrate may be used as an intermediate in the synthesis of (-)-methyl elenolate.
Optically active starting material
储存分类代码
10 - Combustible liquids
WGK
WGK 3
闪点(°F)
163.4 °F - closed cup
闪点(°C)
73 °C - closed cup
个人防护装备
Eyeshields, Gloves, multi-purpose combination respirator cartridge (US)
A new route to substituted 3-methoxycarbonyldihydropyrans; enantioselective synthesis of (-)-methyl elenolate.
Hatakeyama S, et al.
Journal of the Chemical Society. Chemical Communications, 17, 1202-1204 (1988)
Xiao-Hong Chen et al.
PloS one, 9(4), e94543-e94543 (2014-04-18)
A novel carbonyl reductase (AcCR) catalyzing the asymmetric reduction of ketones to enantiopure alcohols with anti-Prelog stereoselectivity was found in Acetobacter sp. CCTCC M209061 and enriched 27.5-fold with an overall yield of 0.4% by purification. The enzyme showed a homotetrameric
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