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2',4',6'-Trihydroxy-3'-methylbutyrophenone

更新时间:2025-08-25 06:27:06

2',4',6'-Trihydroxy-3'-methylbutyrophenone结构式
2',4',6'-Trihydroxy-3'-methylbutyrophenone结构式
委托求购
常用名 2',4',6'-Trihydroxy-3'-methylbutyrophenone 英文名 2',4',6'-Trihydroxy-3'-methylbutyrophenone
CAS号 1509-06-4 分子量 210.22600
密度 N/A 沸点 N/A
分子式 C11H14O4 熔点 N/A
MSDS N/A 闪点 N/A

 名称

英文名 1-(2,4,6-trihydroxy-3-methylphenyl)butan-1-one
英文别名 更多

 物理化学性质

分子式 C11H14O4
分子量 210.22600
精确质量 210.08900
PSA 77.76000
LogP 2.09460
稳定性

1. 存在于主流烟气中。

分子结构

1、 摩尔折射率:56.01

2、 摩尔体积(cm3/mol):165.5

3、 等张比容(90.2K):454.7

4、 表面张力(dyne/cm):56.9

5、 极化率(10-24cm3):22.20

计算化学

1.疏水参数计算参考值(XlogP):2.3

2.氢键供体数量:3

3.氢键受体数量:4

4.可旋转化学键数量:3

5.互变异构体数量:42

6.拓扑分子极性表面积77.8

7.重原子数量:15

8.表面电荷:0

9.复杂度:229

10.同位素原子数量:0

11.确定原子立构中心数量:0

12.不确定原子立构中心数量:0

13.确定化学键立构中心数量:0

14.不确定化学键立构中心数量:0

15.共价键单元数量:1

更多

1. 熔点(ºC):162~163

 安全信息

海关编码 2914400090

 合成线路

~%

2',4',6'-Trihydroxy-3'-methylbutyrophenone结构式

2',4',6'-Trihyd...

1509-06-4

文献:Riedl; Mitteldorf Chemische Berichte, 1956 , vol. 89, p. 2589,2592

~%

2',4',6'-Trihydroxy-3'-methylbutyrophenone结构式

2',4',6'-Trihyd...

1509-06-4

文献:Karrer Helvetica Chimica Acta, 1919 , vol. 2, p. 473

~%

2',4',6'-Trihydroxy-3'-methylbutyrophenone结构式

2',4',6'-Trihyd...

1509-06-4

文献:Karrer Helvetica Chimica Acta, 1919 , vol. 2, p. 473

~%

2',4',6'-Trihydroxy-3'-methylbutyrophenone结构式

2',4',6'-Trihyd...

1509-06-4

文献:Riedl Justus Liebigs Annalen der Chemie, 1954 , vol. 585, p. 38,40

~%

详细
文献:Karrer Helvetica Chimica Acta, 1919 , vol. 2, p. 473

 海关

海关编码 2914400090
中文概述 2914400090 其他酮醇及酮醛。监管条件:无。增值税率:17.0%。退税率:9.0%。最惠国关税:5.5%。普通关税:30.0%
申报要素 品名, 成分含量, 用途, 丙酮报明包装
Summary 2914400090 other ketone-alcohols and ketone-aldehydes。Supervision conditions:None。VAT:17.0%。Tax rebate rate:9.0%。MFN tariff:5.5%。General tariff:30.0%

 英文别名

2.4.6-Trihydroxy-3-butyryl-toluol
2-Butyryl-4-methyl-phloroglucin
Butyrophenone,2',4',6'-trihydroxy-3'-methyl
2',4',6'-Trihydroxy-3'-methylbutyrophenone
2-Methyl-4-butyryl-phloroglucin
3-Methyl-butyrylphloroglucinol
methylphlorbutyrophenon
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