2,2',3,4,5',6-六氯联苯 | 26962-50-5
2,2',3,4,5',6-六氯联苯
2-Propen-1-one,1-(2,4-dihydroxyphenyl)-3-(2-hydroxyphenyl)-
26962-50-5
C15H12O4
256.25338
名称和标识符
MDL |
MFCD00017717 |
InChIKey |
MACMAADVRVVHBD-VMPITWQZSA-N |
Inchi |
InChI=1S/C15H12O4/c16-11-6-7-12(15(19)9-11)14(18)8-5-10-3-1-2-4-13(10)17/h1-9,16-17,19H/b8-5+ |
SMILES |
OC1C=C(O)C=CC=1C(=O)/C=C/C1C=CC=CC=1O |
别名信息
- 中文别名 -
- 2,2,4-三羟基查尔酮
- 2,2',3,4,5',6-六氯联苯
- 英文别名 -
- 2-Propen-1-one,1-(2,4-dihydroxyphenyl)-3-(2-hydroxyphenyl)-
- 1-(2,4-dihydroxyphenyl)-3-(2-hydroxyphenyl)prop-2-en-1-one
- 2,2',4'-Trihydroxychalcone
- 2,2,4-Trihydroxychalcone
- (E)-1-(2,4-dihydroxyphenyl)-3-(2-hydroxyphenyl)-2-propen-1-one
- 2,2',3,4,5',6-HEXACHLOROBIPHENYL
- 2,2',4'-trihydroxylchalcone
- 2',4',2-Trihydroxychalcone
- 2-Propen-1-one,1-(2,4-dihydroxyphenyl)-3-(2-hydroxyphenyl)
- Chalcone,2,2',4'-trihydroxy-(6CI,8CI)
- 2,2'''',4''''-Trihydroxychalcone
- Acrylophenone, 2',4'-dihydroxy-3-(o-hydroxyphenyl)-
- Chalcone, 2,2',4'-trihydroxy-
- 2,2',4'-Trihydroxychalcone, AldrichCPR
- 2-MERCAPTOBENZOTHIAZOLESODIUMSALT
- (E)-1-(2, 4-dihydroxyphenyl)-3-(2-hydroxyphenyl)prop-2-en-1-one
- 2-Propen-1-one, 1-(2,4-dihydroxyphenyl)-3-(2-hydroxyphenyl)-
- CHEMBL148472
- 26962-50-5
- MFCD00017717
- CCRIS 9281
- BDBM50027475
- 1-(2,4-Dihydroxyphenyl)-3-(2-hydroxyphenyl)-2-propen-1-one
- 2,4,2'-Trihydroxychalcone
- AKOS024286651
- (E)-1-(2,4-dihydroxyphenyl)-3-(2-hydroxyphenyl)prop-2-en-1-one
- NSC636790
- NSC 636790
- MACMAADVRVVHBD-VMPITWQZSA-N
- NCI60_012182
- DTXSID001313428
- SCHEMBL322102
- FT-0638653
物化性质
实验特性
LogP |
2.69950 |
PSA |
77.76000 |
折射率 |
1.715 |
沸点 |
505.6 °C at 760 mmHg |
熔点 |
193-194°C |
闪点 |
273.7 °C |
密度 |
1.384 |
计算特性
精确分子量 |
256.07400 |
氢键供体数量 |
3 |
氢键受体数量 |
4 |
可旋转化学键数量 |
3 |
同位素质量 |
256.073559 |
重原子数量 |
19 |
复杂度 |
339 |
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 |
1 |
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) |
3.2 |
拓扑分子极性表面积 |
77.8 |
海关数据
海关编码 |
2914501900 |
海关数据 |
中国海关编码:
2914501900
概述:
2914501900 其他酮酚。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:
2914501900 other ketone-phenols。Supervision conditions:None。VAT:17.0%。Tax rebate rate:9.0%。MFN tariff:5.5%。General tariff:30.0%
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