MDL | MFCD00002552 |
InChIKey | IMVHVWFNMTWNBT-UHFFFAOYSA-N |
Inchi | 1S/C21H38O5Si2/c1-20(2,3)27(9,10)25-18-16(23-7)13-15(14-17(18)24-8)19(22)26-28(11,12)21(4,5)6/h13-14H,1-12H3 |
SMILES | [Si](C([H])([H])[H])(C([H])([H])[H])(C(C([H])([H])[H])(C([H])([H])[H])C([H])([H])[H])OC1C(=C([H])C(=C([H])C=1OC([H])([H])[H])C(=O)O[Si](C([H])([H])[H])(C([H])([H])[H])C(C([H])([H])[H])(C([H])([H])[H])C([H])([H])[H])OC([H])([H])[H] |
BRN | 2115262 |
LogP | 1.10760 |
PSA | 75.99000 |
折射率 | 1.4570 (estimate) |
水溶性 | 5780 mg/L (25 ºC) |
沸点 | 192-193℃/14mmHg(lit.) |
熔点 | 205-209 °C (lit.) |
闪点 | 192-193°C/14mm |
颜色与性状 | Powder |
稳定性 | Stable. Incompatible with strong bases, strong oxidizing agents. |
溶解性 | 易溶于丙酮、乙醚和氯仿,溶于乙醇,为溶于水。 |
敏感性 | 对湿度敏感 |
密度 | 1.2539 (rough estimate) |
精确分子量 | 198.05300 |
氢键供体数量 | 0 |
氢键受体数量 | 5 |
可旋转化学键数量 | 9 |
同位素质量 | 426.22577738 g/mol |
重原子数量 | 28 |
复杂度 | 520 |
同位素原子数量 | 0 |
确定原子立构中心数量 | 0 |
不确定原子立构中心数量 | 0 |
确定化学键立构中心数量 | 0 |
不确定化学键立构中心数量 | 0 |
共价键单元数量 | 1 |
疏水参数计算参考值(XlogP) | 无 |
互变异构体数量 | 4 |
表面电荷 | 0 |
拓扑分子极性表面积 | 54 |
分子量 | 426.7 |
EINECS | 208-486-8 |
海关编码 | 29189090 |
海关数据 |
中国海关编码:2918990090概述:2918990090. 其他含其他附加含氧基羧酸(包括酸酐、酰卤化物、过氧化物和过氧酸及该税号的衍生物). 增值税率:17.0%. 退税率:13.0%. 监管条件:无. 最惠国关税:6.5%. 普通关税:30.0% 申报要素:品名, 成分含量, 用途 Summary:2918990090. other carboxylic acids with additional oxygen function and their anhydrides, halides, peroxides and peroxyacids; their halogenated, sulphonated, nitrated or nitrosated derivatives. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0% |
用途 | 用于有机合成 |
1.
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9.
Photoenhanced uptake of gaseous NO2 on solid organic compounds: a photochemical source of HONO?
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10.
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Reaxys RN | 2115262 |
Beilstein | 2115262 |