一键配货
简介
2-（5-氯噻吩-2-基）喹啉-4-羧酸 1g
基本信息
查看详细信息中文名称
-
英文名称
-
中文别名
-
英文别名
-
CAS号
329222-93-7
分子式
-
分子量
-
更新日期
2026-07-06
技术文档
「暂无技术文档」
相关文章
「暂无相关文章」
Structures
SMILES
C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=C(S3)Cl)C(=O)O
2D Structure
https://labdr.oss-cn-shenzhen.aliyuncs.com/casimg/C3/329222-93-7.svg
3D Conformer
https://labdr.oss-cn-shenzhen.aliyuncs.com/mol3/3/329222-93-7.sdf
Title and Summary
Molecular Weight
289.7
Standard molecular formula
C14H8ClNO2S
Names and Identifiers
IUPAC Name
2-(5-chlorothiophen-2-yl)quinoline-4-carboxylic acid
Other Identifiers
CAS
329222-93-7
PubChem CID
625773
Computed Descriptors
Descriptor.InChI
1S/C14H8ClNO2S/c15-13-6-5-12(19-13)11-7-9(14(17)18)8-3-1-2-4-10(8)16-11/h1-7H,(H,17,18)
Descriptor.InChIKey
GNBCDNSGZAPUEF-UHFFFAOYSA-N
Chemical and Physical Properties
Computed Properties
Property Table.XLogP
4.1
Property Table.Complexity
354
Property Table.Exact Mass
288.9964274
Property Table.Formal Charge
0
Property Table.Heavy Atom Count
19
Property Table.Monoisotopic Mass
288.9964274
Property Table.Isotope Atom Count
0
Property Table.Rotatable Bond Count
2
Property Table.Hydrogen Bond Donor Count
1
Property Table.Covalently-Bonded Unit Count
1
Property Table.Hydrogen Bond Acceptor Count
4
Property Table.Topological Polar Surface Area
78.4
Property Table.Defined Atom Stereocenter Count
0
Property Table.Defined Bond Stereocenter Count
0
Property Table.Undefined Atom Stereocenter Count
0
Property Table.Undefined Bond Stereocenter Count
0
