当前位置: 首页 » 资料 » 化学物质数据库 » NSC166115 2,10-bis(2-hydroxyethyl)undeca-2,9-dienedioic acid,Canonical

NSC166115 2,10-bis(2-hydroxyethyl)undeca-2,9-dienedioic acid,Canonical

放大字体  缩小字体 更新日期:2018-11-26  浏览次数:7
摘 要:NSC166115 2,10-bis(2-hydroxyethyl)undeca-2,9-dienedioic acid,Canonical SMILES: C(CCC=C(CCO)C(=O)O)CCC=C(CCO)C(=O)O,InChI: InChI=1/C15H24O6/c16-10-8-12(14(18)19)6-4-2-1-3-5-7-13(9-11-17)15(20)21/,h6-7,16-17H,1-5,8-11H2,(H,18,19)(H,20,21)/f/h18,20H,Mol
[Synonyms]
NSC166115
[Structure]
NSC166115 2,10-bis(2-hydroxyethyl)undeca-2,9-dienedioic acid,Canonical

[ Properties Computed from Structure]
Molecular Weight300.34746 [g/mol]
Molecular FormulaC15H24O6
XLogP1.2
H-Bond Donor4
H-Bond Acceptor6
Rotatable Bond Count12
Exact Mass300.157289
MonoIsotopic Mass300.157289
Topological Polar Surface Area115
Heavy Atom Count21
Formal Charge0
Complexity348
Isotope Atom Count0
Defined Atom StereoCenter Count0
Undefined Atom StereoCenter Count0
Defined Bond StereoCenter Count0
Undefined Bond StereoCenter Count2
Covalently-Bonded Unit Count1

[ Descriptors Computed from Structure]
IUPAC Name: 2,10-bis(2-hydroxyethyl)undeca-2,9-dienedioic acid
Canonical SMILES: C(CCC=C(CCO)C(=O)O)CCC=C(CCO)C(=O)O
InChI: InChI=1/C15H24O6/c16-10-8-12(14(18)19)6-4-2-1-3-5-7-13(9-11-17)15(20)21/
h6-7,16-17H,1-5,8-11H2,(H,18,19)(H,20,21)/f/h18,20H

 
本文导航:
  • (1) NSC166115 2,10-bis(2-hydroxyethyl)undeca-2,9-dienedioic acid,Canonical
  • 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