2-羟基-3-甲基蒽醌 | 17241-40-6
中文名称:
2-羟基-3-甲基蒽醌
英文名称:
2-Hydroxy-3-methylanthraquinone
CAS No.:
17241-40-6
分子式:
C1 5 H1 0 O3
分子量:
238.2381
名称和标识符
InChIKey
RNJHIYAJJKOFIO-UHFFFAOYSA-N
Inchi
InChI=1S/C15H10O3/c1-8-6-11-12(7-13(8)16)15(18)10-5-3-2-4-9(10)14(11)17/h2-7,16H,1H3
SMILES
CC1=CC2=C(C=C1O)C(=O)C3=CC=CC=C3C2=O
别名信息
- 英文别名 -
2-Hydroxy-3-methylanthracene-9,10-dione
2-Hydroxy-3-methylanthraquinone
9,10-Anthracenedione,2-hydroxy-3-methyl-
2-hydroxy-3-methyl-anthracene-9,10-dione
2-Hydroxy-3-methyl-anthrachinon
3-hydroxy-2-methyl-9,10-anthraquinone
3-hydroxy-2-methylanthraquinone
3-Oxy-2-methyl-anthrachinon
W1213
[
""
]
2-Hydroxy-3-methylanthraquine
2-hydroxy-3-methyl antraquinone
D85135
SCHEMBL6051235
HY-N7160
FS-10474
17241-40-6
AKOS015909671
CS-0103744
2-HYDROXY-3-METHYL ANTRAQUINONE
CHEMBL3896634
DTXSID20447312
2-Hydroxy-3-Methylanthraquinone
2-Hydroxy-3-Methylanthracene-9,10-dione
物化性质
实验特性
LogP
2.47600
PSA
54.37000
沸点
439.7±34.0 °C at 760 mmHg
蒸气压
0.0±1.1 mmHg at 25°C
闪点
233.8±22.2 °C
颜色与性状
Yellow powder
密度
1.4±0.1 g/cm3
计算特性
精确分子量
238.06300
氢键供体数量
1
氢键受体数量
3
可旋转化学键数量
0
同位素质量
238.062994177g/mol
重原子数量
18
复杂度
376
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)
2.9
拓扑分子极性表面积
54.4Ų
海关数据
海关编码
2914690090
海关数据
中国海关编码:
2914690090
概述:
2914690090 其他醌. 增值税率:17.0% 退税率:9.0% 监管条件:无 最惠国关税:5.5% 普通关税:30.0%
Summary:
2914690090 other quinones。Supervision conditions:None。VAT:17.0%。Tax rebate rate:9.0%。MFN tariff:5.5%。General tariff:30.0%
相关文献
1.
Health functions and structure–activity relationships of natural anthraquinones from plants
Yu Li,Jian-Guo Jiang Food Funct. 2018 9 6063
2.
Application of HPLC-Q/orbitrap MS in the detection and identification of anticancer constituents in ethyl acetate components from Hedyotis diffusa
Xi Chen,Baojin Zhao,Mengjiao Zhang,Min Dong,Yunlan Li,Qingshan Li Anal. Methods 2020 12 4037
3.
Naturally occurring quinones. Part X. The quinonoid constituents of Tabebuia avellanedae(Bignoniaceae)
A. R. Burnett,R. H. Thomson J. Chem. Soc. C 1967 2100
4.
Journey of anthraquinones as anticancer agents – a systematic review of recent literature
M. Shaheer Malik,Reem I. Alsantali,Rabab S. Jassas,Abdulrahman A. Alsimaree,Riyaz Syed,Meshari A. Alsharif,Kulkarni Kalpana,Moataz Morad,Ismail I. Althagafi,Saleh A. Ahmed RSC Adv. 2021 11 35806
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