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:107-47-1
Name:di-tert-butyl sulfide
Description:
Labels:Sulfides/thiophenes
CAS:107-47-1
InChi Code:InChI=1S/C8H18S/c1-7(2,3)9-8(4,5)6/h1-6H3

Properties

FP: Flash point [K]

ValueSource or prediction
314

experimental value

310

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

318

Tab5: FFNN model for flash point (Training set)

AIT: Auto-Ignition Temperature [K]

ValueSource or prediction
524

experimental value

517

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

503

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

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