一键配货
简介
4-Chloro-5-fluoroquinazoline
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
16499-60-8
分子式
-
分子量
-
更新日期
2026-07-06
技术文档
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相关文章
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Structures
SMILES
C1=CC2=C(C(=C1)F)C(=NC=N2)Cl
2D Structure
https://labdr.oss-cn-shenzhen.aliyuncs.com/casimg/C1/16499-60-8.svg
3D Conformer
https://labdr.oss-cn-shenzhen.aliyuncs.com/mol3/1/16499-60-8.sdf
Title and Summary
Molecular Weight
182.58
Standard molecular formula
C8H4ClFN2
Names and Identifiers
IUPAC Name
4-chloro-5-fluoroquinazoline
Other Identifiers
CAS
16499-60-8
PubChem CID
11974445
Computed Descriptors
Descriptor.InChI
1S/C8H4ClFN2/c9-8-7-5(10)2-1-3-6(7)11-4-12-8/h1-4H
Descriptor.InChIKey
NRVNUZHSKMEHOT-UHFFFAOYSA-N
Chemical and Physical Properties
Computed Properties
Property Table.XLogP
2.6
Property Table.Complexity
167
Property Table.Exact Mass
182.0047040
Property Table.Formal Charge
0
Property Table.Heavy Atom Count
12
Property Table.Monoisotopic Mass
182.0047040
Property Table.Isotope Atom Count
0
Property Table.Rotatable Bond Count
0
Property Table.Hydrogen Bond Donor Count
0
Property Table.Covalently-Bonded Unit Count
1
Property Table.Hydrogen Bond Acceptor Count
3
Property Table.Topological Polar Surface Area
25.8
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
