喹哪啶酸 | 93-10-7
中文名称:
喹哪啶酸
英文名称:
Quinoline-2-carboxylic acid
CAS No.:
93-10-7
分子式:
C1 0 H7 NO2
分子量:
173.168082475662
如需查看该化合物的详细结构式,mol文件,smile,InChi 请点击:喹哪啶酸结构式
名称和标识符
MDL
MFCD00006752
InChIKey
LOAUVZALPPNFOQ-UHFFFAOYSA-N
Inchi
1S/C10H7NO2/c12-10(13)9-6-5-7-3-1-2-4-8(7)11-9/h1-6H,(H,12,13)
SMILES
O=C(C1C=CC2C(=CC=CC=2)N=1)O
BRN
0126322
别名信息
- 中文别名 -
喹哪啶酸
喹啉-2-羧酸 (喹哪啶酸)
喹啉-2-甲酸
2-喹啉羧酸
α-喹啉羧酸
2-羧基喹啉
喹啉-2-羧酸
喹哪啶酸,二水
喹哪啶酸(喹啉-2-羧酸)
2-喹啉甲酸
Quinaldic Acid 喹哪啶酸
喹哪啶酸,AR
奎哪啶酸
- 英文别名 -
Quinoline-2-carboxylic acid
2-Quinolinecarboxylic acid
Quinoline-2-carboxylic acid (Quinaldic acid)
RARECHEM AL BO 1348
QUINALDINIC ACID
TIMTEC-BB SBB003820
2-QUINOLINECARBOCYLIC ACID
Quinaldic Acid
2-Carboxyquinoline
2-Quinolinylcarboxylic acid
2-Quinoline carboxylic acid
Quinaldate
2-Quinolinecarboxylate
2-quinaldic acid
Quinolinecarboxylic acid
2-quinoline-carboxylic acid
QUINALDIC ACID, 99%
P90NWT719R
LOAUVZALPPNFOQ-UHFFFAOYSA-N
quinoline-2-carboxylic acid (quinaldic
Quinaldic acid (8CI)
2-Quinolinic acid
NSC 4882
Quinaldinic acid
Quinolin-2-carboxylic acid
2-Quinolinecarboxylic Acid
物化性质
实验特性
LogP
1.93300
PSA
50.19000
Merck
8046
折射率
1.5200 (estimate)
水溶性
溶解
沸点
348.7°C at 760 mmHg
熔点
156-158 °C (lit.)
闪点
164.7℃
FEMA
2723
溶解度
14g/l
颜色与性状
白色结晶 ,无气味。
PH值
3.0-3.5 (10g/l, H2O, 20℃)
溶解性
溶于乙醇和碱溶液,略溶于水。
密度
1.2427 (rough estimate)
计算特性
精确分子量
173.04800
氢键供体数量
1
氢键受体数量
3
可旋转化学键数量
1
同位素质量
173.048
重原子数量
13
复杂度
205
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)
1.6
表面电荷
0
拓扑分子极性表面积
50.2
海关数据
海关编码
29334990
海关数据
中国海关编码:
2933499090
概述:
2933499090. 其他含喹琳或异喹啉环系的化合物〔但未进一步稠合的〕. 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:20.0%
申报要素:
品名, 成分含量, 用途, 乌洛托品请注明外观, 6-己内酰胺请注明外观, 签约日期
Summary:
2933499090. other compounds containing in the structure a quinoline or isoquinoline ring-system (whether or not hydrogenated), not further fused. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%
相关文献
1.
Eco-efficient synthesis of 2-quinaldic acids from furfural
Minghao Li,Xiaohan Dong,Na Zhang,Fran?ois Jér?me,Yanlong Gu Green Chem. 2019 21 4650
2.
Enzymatic approaches to site-selective oxidation of quinoline and derivatives
Zhongqiang Wang,Ling Zhao,Xueqing Mou,Yongzheng Chen Org. Biomol. Chem. 2022 20 2580
3.
Oxorhenium(v) complexes of quinoline and isoquinoline carboxylic acids – synthesis, structural characterization and catalytic application in epoxidation reactions
Barbara Machura,Mariusz Wolff,Eric Benoist,J?rg A. Schachner,Nadia C. M?sch-Zanetti Dalton Trans. 2013 42 8827
4.
Biosynthesis of 8-hydroxyquinoline-2-carboxylic acid, an iron chelator from the gut of the lepidopteran Spodoptera littoralis
Jelena Pesek,Ji?í Svoboda,Martina Sattler,Stefan Bartram,Wilhelm Boland Org. Biomol. Chem. 2015 13 178
5.
Structural motifs in phenylbismuth heterocyclic carboxylates – secondary interactions leading to oligomers
O. Anjaneyulu,D. Maddileti,K. C. Kumara Swamy Dalton Trans. 2012 41 1004
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Structural motifs in phenylbismuth heterocyclic carboxylates – secondary interactions leading to oligomers
O. Anjaneyulu,D. Maddileti,K. C. Kumara Swamy Dalton Trans. 2012 41 1004
7.
Structural motifs in phenylbismuth heterocyclic carboxylates – secondary interactions leading to oligomers
O. Anjaneyulu,D. Maddileti,K. C. Kumara Swamy Dalton Trans. 2012 41 1004
8.
A simple quinoline-derived fluorescent sensor for the selective and sequential detection of copper(ii) and sulfide ions and its application in living-cell imaging
Haiyang Liu,Fengxu Wu,Bibo Zhang,Chunyan Tan,Yuzong Chen,Gefei Hao,Ying Tan,Yuyang Jiang RSC Adv. 2016 6 77508
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参考资料
Reaxys RN
126322
Beilstein
126322
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