4964-27-6 (diethylarsinic acid,Diethylarsinic Acid)

CAS号:
4964-27-6
中文名称:
diethylarsinic acid
英文名称:
Diethylarsinic Acid
分子式:
C4H11AsO2
分子量:
166.050542116165

diethylarsinic acid(4964-27-6)名称与标识符

名称

中文别名:
diethylarsinic acid;
英文别名:
Diethylarsinic Acid;Diaethylarsinsaeure;Arsinic acid, diethyl- (9CI);diethylarsenic acid;Diethylhydroxy arsine oxide;AC1L2HKL;Diethyl arsinic acid;ARSINE OXIDE, DIETHYLHYDROXY-;(Diethylhydroxy)arsine oxide;BRN 1743728;Arsinic acid, diethyl-;Diaethyl-arsinsaeure;diethyl-arsinic acid;Diaethylarsinigsaeure;Diethyl-arsinsaeure;Diaethylarsinsaeure; Arsinic acid, diethyl- (9CI); diethylarsenic acid; Diethylhydroxy arsine oxide; AC1L2HKL; Diethyl arsinic acid; ARSINE OXIDE, DIETHYLHYDROXY-; (Diethylhydroxy)arsine oxide; BRN 1743728; Arsinic acid, diethyl-; Diaethyl-arsinsaeure; diethyl-arsinic acid; Diaethylarsinigsaeure; Diethyl-arsinsaeure;;4964-27-6;As,As-Diethylarsinic acid;WLN: Q-AS-O&2&2;Diethylhydroxyarsine oxide;SCHEMBL8930988;ANTINEOPLASTIC-152889;Arsinic acid, As,As-diethyl-;NSC152889;DTXSID60197945;L8MG5ZT4NJ;NSC 152889;NSC-152889;

标识符

InChIKey:
JJABJBOSZVTCOY-UHFFFAOYSA-N
Inchi:
1S/C4H11AsO2/c1-3-5(6,7)4-2/h3-4H2,1-2H3,(H,6,7)
SMILES:
[As](CC)(CC)(=O)O

diethylarsinic acid(4964-27-6)物化性质

实验特性

  • LogP : 0.89120
  • PSA : 37.3

计算特性

  • 精确分子量 : 165.99753
  • 氢键供体数量 : 1
  • 氢键受体数量 : 2
  • 可旋转化学键数量 : 2
  • 同位素质量 : 165.997499g/mol
  • 重原子数量 : 7
  • 复杂度 : 81.7
  • 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 : 0
  • 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
  • 拓扑分子极性表面积 : 37.3Ų

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