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Merck
CN

74830

辛烷分馏物

purum

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PubChem Substance ID:
UNSPSC Code:
12190000
EC Number:
203-892-1
MDL number:
Beilstein/REAXYS Number:
1696875
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grade

purum

refractive index

n20/D 1.397

bp

124-128 °C

SMILES string

CCCCCCCC

法规信息

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Michael H Abraham et al.
European journal of medicinal chemistry, 44(2), 885-890 (2008-07-08)
The convulsant activity of 48 compounds studied by Eger et al. has been analyzed using an Abraham solvation equation. Four compounds identified by Eger et al. as more potent than expected were similarly identified, and for the remaining 44 compounds
A A Toropov et al.
European journal of medicinal chemistry, 43(4), 714-740 (2007-07-17)
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. Statistical characteristics of the best model (vitamins) are the

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