当前位置: 首页 » 资料 » 化学物质数据库 » Oprea1_213550,Oprea1_390655, 1-(4-methoxy-3-methylphenyl)sulfonylimida

Oprea1_213550,Oprea1_390655, 1-(4-methoxy-3-methylphenyl)sulfonylimida

放大字体  缩小字体 更新日期:2018-11-26  浏览次数:5
摘 要:Oprea1_213550,Oprea1_390655, 1-(4-methoxy-3-methylphenyl)sulfonylimidazole,Canonical SMILES: CC1=C(C=CC(=C1)S(=O)(=O)N2C=CN=C2)OC,InChI: InChI=1/C11H12N2O3S/c1-9-7-10(3-4-11(9)16-2)17(14,,15)13-6-5-12-8-13/h3-8H,1-2H3,Molecular Weight252.28958 [g/mol
[Synonyms]
Oprea1_213550
Oprea1_390655

[Structure]
Oprea1_213550,Oprea1_390655, 1-(4-methoxy-3-methylphenyl)sulfonylimida

[ Properties Computed from Structure]
Molecular Weight252.28958 [g/mol]
Molecular FormulaC11H12N2O3S
XLogP1.5
H-Bond Donor0
H-Bond Acceptor5
Rotatable Bond Count3
Exact Mass252.056863
MonoIsotopic Mass252.056863
Topological Polar Surface Area61.2
Heavy Atom Count17
Formal Charge0
Complexity352
Isotope Atom Count0
Defined Atom StereoCenter Count0
Undefined Atom StereoCenter Count0
Defined Bond StereoCenter Count0
Undefined Bond StereoCenter Count0
Covalently-Bonded Unit Count1

[ Descriptors Computed from Structure]
IUPAC Name: 1-(4-methoxy-3-methylphenyl)sulfonylimidazole
Canonical SMILES: CC1=C(C=CC(=C1)S(=O)(=O)N2C=CN=C2)OC
InChI: InChI=1/C11H12N2O3S/c1-9-7-10(3-4-11(9)16-2)17(14,
15)13-6-5-12-8-13/h3-8H,1-2H3

 
本文导航:
  • (1) Oprea1_213550,Oprea1_390655, 1-(4-methoxy-3-methylphenyl)sulfonylimida
  • 下一篇:鳖甲
  • 上一篇:暂无
 
[ 资料搜索 ]  [ 加入收藏 ]  [ 告诉好友 ]  [ 打印本文 ]  [ 关闭窗口 ]

 

 
推荐图文
推荐资料
热门关注