50874-31-2 ((-)-Alpha-(2,4,5,7-四硝基-9-亚芴基氨基氧基)丙酸,(-)-alpha-(2,4,5,7-tetranitro-9-fluorenylideneaminoxy)propionic acid)

CAS号:
50874-31-2
中文名称:
(-)-Alpha-(2,4,5,7-四硝基-9-亚芴基氨基氧基)丙酸
英文名称:
(-)-alpha-(2,4,5,7-tetranitro-9-fluorenylideneaminoxy)propionic acid
分子式:
C16H9N5O11
分子量:
447.269563436508

(-)-Alpha-(2,4,5,7-四硝基-9-亚芴基氨基氧基)丙酸(50874-31-2)名称与标识符

名称

中文别名:
(-)-2-(2,4,5,7-四硝基-9-亚芴基氨氧基)丙酸;(-)-Alpha-(2,4,5,7-四硝基-9-亚芴基氨基氧基)丙酸;
英文别名:
(-)-alpha-(2,4,5,7-tetranitro-9-fluorenylideneaminoxy)propionic acid;(R)-< < (tetranitrofluorenylidene)amino> oxy> propionic acid;(R)-2-(2,4,5,7-tetranitro-fluoren-9-ylidenaminooxy)-propionic acid;(R)-2-(2,4,5,7-Tetranitro-fluoren-9-ylidenaminooxy)-propionsaeure;(R)-2-< 2,4,5,7-tetranitro-fluoren-9-yl;(R)-3,4-epoxy-1-butanol PMB ether;4-(p-methoxybenzyloxy)-1,2-epoxybutane;Oxirane, [2-[(4-methoxyphenyl)methoxy]ethyl]-, (R)-;R(-)2-(2,4,5,7-tetranitro-9-fluorenyloximino)propanoic acid;A835321;DB-259935;(+)-2-(2,4,5,7-tetranitro-9-fluorenylideneaminoxy) propionic acid;2-(2,4,5,7-TETRANITRO-9-FLUORENYLIDENEAMINOOXY)PROPIONIC ACID;alpha-(2,4,5,7-Tetranitro-9-fluorenyldieneaminooxy)propionic acid;2-([(2,4,5,7-Tetranitro-9H-fluoren-9-ylidene)amino]oxy)propanoic acid #;5001-45-6;SCHEMBL733623;AKOS024318979;(+)-.alpha.-(2,4,5,7-Tetranitro-9-fluorenylideneaminoxy)propionic acid;2-(2,4,5,7-Tetranitro-9-fluorenylideneaminooxy)propionicacid;CHEMBL314151;Propanoic acid, 2-(((2,4,5,7-tetranitro-9H-fluoren-9-ylidene)amino)oxy)-;DB-051873;2-[(2,4,5,7-tetranitro-9-fluorenylidene)amino]oxypropanoic acid;2-[(2,4,5,7-tetranitrofluoren-9-ylidene)amino]oxypropanoic acid;NSC-54795;(+),(-)-A-2,4,5,7-TETRANITRO-9-FLUORENYLIDENEAMINOOXYPROPIONIC ACID;2-(2,4,5,7-Tetranitro-fluoren-9-ylideneaminooxy)-propionic acid;50874-31-2;66069-40-7;NSC 54795;MQTMHRXULFJFOC-UHFFFAOYSA-N;NSC54795;

标识符

InChIKey:
MQTMHRXULFJFOC-UHFFFAOYSA-N
Inchi:
1S/C16H9N5O11/c1-6(16(22)23)32-17-15-9-2-7(18(24)25)4-11(20(28)29)13(9)14-10(15)3-8(19(26)27)5-12(14)21(30)31/h2-6H,1H3,(H,22,23)
SMILES:
O(C(C(=O)O)C)/N=C1/C2C=C(C=C(C=2C2C(=CC(=CC=2/1)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

(-)-Alpha-(2,4,5,7-四硝基-9-亚芴基氨基氧基)丙酸(50874-31-2)物化性质

实验特性

  • 熔点 : 196-199 °C(lit.)

计算特性

  • 精确分子量 : 447.02985612g/mol
  • 氢键供体数量 : 1
  • 氢键受体数量 : 12
  • 可旋转化学键数量 : 3
  • 同位素质量 : 447.02985612g/mol
  • 重原子数量 : 32
  • 复杂度 : 800
  • 同位素原子数量 : 0
  • 确定原子立构中心数量 : 0
  • 不确定原子立构中心数量 : 1
  • 确定化学键立构中心数量 : 0
  • 不确定化学键立构中心数量 : 0
  • 共价键单元数量 : 1
  • 疏水参数计算参考值(XlogP) : 3
  • 拓扑分子极性表面积 : 242Ų

(-)-Alpha-(2,4,5,7-四硝基-9-亚芴基氨基氧基)丙酸(50874-31-2)安全信息

(-)-Alpha-(2,4,5,7-四硝基-9-亚芴基氨基氧基)丙酸(50874-31-2)相关文献