10967/130 - QDB Compounds

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Bagheri, M.; Borhani, T. N. G.; Zahedi, G. Estimation of flash point and autoignition temperature of organic sulfur chemicals. Energy Convers. Manage. 2012, 58, 185–196.

Compound

ID:1207-12-1
Name:4,6-dimethyldibenzothiophene
Description:
Labels:Sulfides/thiophenes
CAS:1207-12-1
InChi Code:InChI=1S/C14H12S/c1-9-6-7-12-11(8-9)14-10(2)4-3-5-13(14)15-12/h3-8H,1-2H3

Properties

FP: Flash point [K]

ValueSource or prediction
473

experimental value

446

Eq6: PSO-MLR model for flash point (Training set)

458

Tab5: FFNN model for flash point (Training set)

AIT: Auto-Ignition Temperature [K]

ValueSource or prediction
738

experimental value

736

Eq7: PSO-MLR model for auto-ignition temperature (Training set)

712

Tab6: FFNN model for auto-ignition temperature (Training set)

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