[(3aR,5R,6S,6aR)-5-[(1R)-1,2-dihydroxyethyl]-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-6-yl] butanoate

[(3aR,5R,6S,6aR)-5-[(1R)-1,2-dihydroxyethyl]-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-6-yl] butanoate 基本信息
CAS号 125161-47-9 分子式 C13H22O7
分子量 290.31000 精确质量  290.13700
PSA  94.45000 LogP  -0.07210

基本信息 展开↓

CAS号:
125161-47-9
3D弹球模型:
立即前往扯扯看
分子式:
C13H22O7
分子量:
290.31000
英文名称:
[(3aR,5R,6S,6aR)-5-[(1R)-1,2-dihydroxyethyl]-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-6-yl] butanoate
英文别名:
[(3aR,5R,6S,6aR)-5-[(1R)-1,2-dihydroxyethyl]-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-6-yl] butanoate;
Monoacetone glucose 3-butyrate;
Mag-3BUT;
Monobut-3;
Esterbut-3
精确分子量/精确质量:
290.13700
极性分子表面积/PSA:
94.45000
油水分配系数/LogP:

LogP值指的是某物质在正辛醇/水两相体系中的分配系数的对数值,反映了物质在油水两相中的分配情况。其中、LogP值越大,说明该物质越亲油;反之,LogP值越小,则说明该物质越亲水。
InChI:
The Key: WFVFQUPBGWFLMB-DVYMNCLGSA-N

物化性质展开↓

密度:
1.28g/cm3
沸点:
415.3ºC at 760 mmHg
闪点:
151.5ºC
折射率:
1.515
蒸汽压:
1.24E-08mmHg at 25°C

合成路线查看所有的合成路线

  • 109984-82-9

    [(5R,6S)-5-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-6-yl] butanoate

  • ~80%

  • 125161-47-9

    [(3aR,5R,6S,6aR)-5-[(1R)-1,2-dihydroxyethyl]-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-6-yl] butanoate

  • 582-52-5

    二丙酮-D-葡萄糖

  • 125161-47-9

    [(3aR,5R,6S,6aR)-5-[(1R)-1,2-dihydroxyethyl]-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-6-yl] butanoate

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  • 109984-82-9

    [(5R,6S)-5-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-6-yl] butanoate

  • 582-52-5

    二丙酮-D-葡萄糖

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