SIMPLE APPROACH FOR PREDICTION OF MELTING POINTS OF ORGANIC MOLECULES CONTAINING HAZARDOUS PEROXIDE BONDS

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HAMADANIAN KHOZANI MASOOD; KESHAVARZ MOHAMMAD HOSSEIN; NAZARI BEHZAD; MOHEBBI MOSTAFA

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Paper Information

Journal: JOURNAL OF THE IRANIAN CHEMICAL SOCIETY(JICS) Year:2015 | Volume:12 | Issue:4 Page(s): 587-598

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Information Journal Paper

Title

SIMPLE APPROACH FOR PREDICTION OF MELTING POINTS OF ORGANIC MOLECULES CONTAINING HAZARDOUS PEROXIDE BONDS

Author(s)

HAMADANIAN KHOZANI MASOOD | KESHAVARZ MOHAMMAD HOSSEIN | NAZARI BEHZAD | MOHEBBI MOSTAFA | Issue Writer Certificate

Keywords

MELTING POINT

PEROXIDE COMPOUND

CORRELATION

SAFETY

Abstract

In this work, a new and simple method is proposed to estimate the MELTING POINTs of hazardous organic PEROXIDE COMPOUNDs including hydro peroxides, dialkyl peroxides, primary and secondary ozonides, peroxyacids, diacyl peroxides and alkyl peroxyesters compounds. This method can be applied for any PEROXIDE COMPOUND with general formula CxHyOz to predict its MELTING POINT on the basis of elemental composition and specific structural moieties as additive and non-additive functions. It was applied for 104 different PEROXIDE COMPOUNDs including complex molecular structures. The predicted results give more reliable results in comparison to two of the best available methods. The average and maximum percent deviations of the new method are 6.8 and 21.1, respectively, which are lower than corresponding predicted values of Joback–Reid (24.1 and 101.9) and Jain–Yalkowsky (25.4 and 211.1).

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APA: Copy

HAMADANIAN KHOZANI, MASOOD, KESHAVARZ, MOHAMMAD HOSSEIN, NAZARI, BEHZAD, & MOHEBBI, MOSTAFA. (2015). SIMPLE APPROACH FOR PREDICTION OF MELTING POINTS OF ORGANIC MOLECULES CONTAINING HAZARDOUS PEROXIDE BONDS. JOURNAL OF THE IRANIAN CHEMICAL SOCIETY(JICS), 12(4), 587-598. SID. https://sid.ir/paper/283072/en

Vancouver: Copy

HAMADANIAN KHOZANI MASOOD, KESHAVARZ MOHAMMAD HOSSEIN, NAZARI BEHZAD, MOHEBBI MOSTAFA. SIMPLE APPROACH FOR PREDICTION OF MELTING POINTS OF ORGANIC MOLECULES CONTAINING HAZARDOUS PEROXIDE BONDS. JOURNAL OF THE IRANIAN CHEMICAL SOCIETY(JICS)[Internet]. 2015;12(4):587-598. Available from: https://sid.ir/paper/283072/en

IEEE: Copy

MASOOD HAMADANIAN KHOZANI, MOHAMMAD HOSSEIN KESHAVARZ, BEHZAD NAZARI, and MOSTAFA MOHEBBI, “SIMPLE APPROACH FOR PREDICTION OF MELTING POINTS OF ORGANIC MOLECULES CONTAINING HAZARDOUS PEROXIDE BONDS,” JOURNAL OF THE IRANIAN CHEMICAL SOCIETY(JICS), vol. 12, no. 4, pp. 587–598, 2015, [Online]. Available: https://sid.ir/paper/283072/en

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