ethyl 7-chloro-1-ethyl-6-fluoro-4-oxoquinoline-5-carboxylate
- 中文别名：7-氯-1-乙基-6-氟-1,4-二氢-4-氧代喹啉-3-羧酸乙酯
- 中文释义：7-氯-1-乙基-6-氟-1,4-二氢-4-氧代喹啉-3-羧酸乙酯;7-氯-1-乙基-6-氟-1,4-二氢-4-氧代-喹啉-5-羧酸乙酯
- 英文别名：ethyl 7-chloro-1-ethyl-6-fluoro-4-oxoquinoline-5-carboxylate;
7-chloro-1-ethyl-6-fluoro-4-oxo-5-quinolinecarboxylic acid ethyl ester;
ethyl-1-ethyl-6-fluoro-7-chloro-4-oxo-1,4-dihydro-quinoline-3-carboxylate;
ETHYL 7-CHLORO-1-ETHYL-6-FLUORO-1,4-DIHYDRO-4-OXO-QUINOLINE-5-CARBOXYLATE;
3-Quinolinecarboxylic acid,7-chloro-1-ethyl-6-fluoro-1,4-dihydro-4-oxo-,ethyl ester;
7-chloro-3-ethoxy-carbonyl-1-ethyl-6-fluoro-4-oxo-1,4-dihydroquinoline;
ethyl 7-chloranyl-1-ethyl-6-fluoranyl-4-oxidanylidene-quinoline-5-carboxylate;
1-ethyl-6-fluoro-7-chloro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid ethyl ester;
ethyl 7-chloro-1-ethyl-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylate;
7-chloro-1-ethyl-6-fluoro-1,4-dihydro-4-oxo-3-quinolinecarboxylic acid,ethyl ester
- CAS No.：70458-94-5
- 分子式：
C14H13ClFNO3
- 分子量：297.70900
- 精确分子量：297.05700
- PSA：48.30000
- InChI：The Key: NGBZZCXZVDYZQK-UHFFFAOYSA-N
- 分子结构式：
分子结构与计算化学数据
计算化学数据
1.疏水参数计算参考值（XlogP）:3
2.氢键供体数量:0
3.氢键受体数量:5
4.可旋转化学键数量:4
5.互变异构体数量:无
6.拓扑分子极性表面积:46.6
7.重原子数量:20
8.表面电荷:0
9.复杂度:429
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
