Structure-property correlation equation: VI. Accessible surface areas of hydrocarbon molecules and simple procedures for their approximate estimation

被引：0

作者：

Golovanov, IB ^{[1
]}

Tsygankova, IG ^{[1
]}

机构：

[1] Russian Acad Sci, Inst Theoret & Expt Biophys, Pushchino 142292, Moscow Oblast, Russia

来源：

RUSSIAN JOURNAL OF GENERAL CHEMISTRY | 2001年 / 71卷 / 06期

关键词：

D O I：

10.1023/A:1012306829346

中图分类号：

O6 [化学];

学科分类号：

0703 ;

摘要：

The molecule surface area accessible for a solvent is considered as a property apparently related to the molecular conformation. With this "ideal" property as example, the methodological aspects are considered of choosing an analytical expression for the structure-property correlation equation and of determining the parameters of this equation.

引用

页码：833 / 838

页数：6

共 10 条

[1] Structure-Property Correlation Equation: VI. Accessible Surface Areas of Hydrocarbon Molecules and Simple Procedures for Their Approximate Estimation
I. B. Golovanov
I. G. Tsygankova
Russian Journal of General Chemistry, 2001, 71 : 833 - 838
[2] Structure-property correlation equation: II. Estimations of some physicochemical properties of hydrocarbon molecules
Golovanov, IB
Tsygankova, IG
RUSSIAN JOURNAL OF GENERAL CHEMISTRY, 1999, 69 (12) : 1928 - 1932
[3] Structure-Property Correlation Equation: IV. Estimation of the Logarithm of the Distribution Factor of Flexible Hydrocarbon Molecules in the Octanol-Water System
I. B. Golovanov
I. G. Tsygankova
Russian Journal of General Chemistry, 2001, 71 : 500 - 504
[4] Structure-property correlation equation: IV. Estimation of the logarithm of the distribution factor of flexible hydrocarbon molecules in the octanol-water system
Golovanov, IB
Tsygankova, IG
RUSSIAN JOURNAL OF GENERAL CHEMISTRY, 2001, 71 (04) : 500 - 504
[5] The structure-property correlation equation and estimation of the antiprotozoal activiy of glutathione derivatives
Golovanov, I.B.
Zhenodarova, S.M.
Ivanitskij, G.R.
Khabarova, M.I.
Doklady Akademii Nauk, 2002, 387 (01) : 113 - 116
[6] Structure-Property correlation for estimating the Gibbs energies of transfer of hydrocarbon molecules from the gas phase to water and hydrophobic interactions
Golovanov, IB
Tsygankova, IG
ZHURNAL FIZICHESKOI KHIMII, 1998, 72 (04): : 599 - 603
[7] Structure-property correlation equation: III. Distribution factors of organic molecules of various classes in the octanol-water system
Golovanov, IB
Tsygankova, IG
RUSSIAN JOURNAL OF GENERAL CHEMISTRY, 2000, 70 (02) : 206 - 213
[8] Structure-property correlation equation: I. Description of approach. Estimation of the heats of vaporization of organic compounds from various classes
Golovanov, IB
Tsygankova, IG
RUSSIAN JOURNAL OF GENERAL CHEMISTRY, 1999, 69 (08) : 1227 - 1233
[9] Structure-property correlation equation: V. Estimations of the distribution factors of molecules containing several polar groups in the octanol-water system
Golovanov, IB
Tsygankova, IG
RUSSIAN JOURNAL OF GENERAL CHEMISTRY, 2001, 71 (05) : 712 - 717
[10] Structure-Property Correlation Equation: V. Estimations of the Distribution Factors of Molecules Containing Several Polar Groups in the Octanol-Water System
I. B. Golovanov
I. G. Tsygankova
Russian Journal of General Chemistry, 2001, 71 : 712 - 717

← 1 →