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1-氯庚烷

1-氯庚烷结构式
1-氯庚烷结构式
品牌特惠专场
常用名 1-氯庚烷 英文名 1-Chloroheptane
CAS号 629-06-1 分子量 134.647
密度 0.9±0.1 g/cm3 沸点 158.8±3.0 °C at 760 mmHg
分子式 C7H15Cl 熔点 −69 °C(lit.)
MSDS 中文版 美版 闪点 41.7±0.0 °C
符号 GHS02 GHS07
GHS02, GHS07
信号词 Warning

QSPR modeling of octanol/water partition coefficient for vitamins by optimal descriptors calculated with SMILES.

Eur. J. Med. Chem. 43 , 714-40, (2008)

Simplified molecular input line entry system (SMILES) has been utilized in constructing quantitative structure-property relationships (QSPR) for octanol/water partition coefficient of vitamins and organic compounds of different classes by optimal descriptors....

Barnes JH, et al.

J. Anal. At. Spectrom. 19(6) , 751-756, (2004)