Chin. J. Org. Chem. ›› 2002, Vol. 22 ›› Issue (11): 897-901. Previous Articles     Next Articles

分子诱导效应指数与脂肪族醛酮的沸点

张秀利;汪勇先;李俊玲;林英武   

  1. 中国科学院上海原子核研究所.上海(201800)
  • 发布日期:2002-11-25

Molecular inductive effect index and boiling point of aliphatic aldehydes and alkanones

Zhang Xiuli;Wang Yongxian;Li Junling;Lin Yingwu   

  1. Shanghai Institute of Nuclear Research, Chinese Academy of Sciences.Shanghai(201800)
  • Published:2002-11-25

Based on the molecular inductive effect index, a formula consisting of three parameters was proposed to calculate the boiling point of aliphatic aldehydes and alkanones. ln (820.5 - T_b) = 6.38327 - 1. 23961 * 10~(-1)N_c + 1.95353ΔI + 6.68434 * 10~(-2)N, where the N_c is the effective length of carbon chain of alkyl group in the aliphatic aldehydes and alkanones. The ΔI is the inductive effect index difference between the corresponding branched and normal alkyl isomer containing the same carbon atom number, which expresses the effect of carbonyl group on the boiling point of aliphatic aldehydes and alkanones. N is the numbers of carbon atoms of aliphatic aldehydes and alkanones.

Key words: MOLECULAR;INDUCTIVE EFFECT;EXPONENT;BOILING POINTS, ALIPHATIC ALDEHYDES;ALIPHATIC KETONES;ACTIVITY

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