10967/4 - QDB Compounds

QsarDB Repository

Abramowitz, R.; Yalkowsky, S.H. Melting Point, Boiling Point, and Symmetry. Pharm. Res. 1990, 7, 9, 942–947.

Compound

ID:79
Name:4-Bromobenzonitrile
Description:
Labels:
CAS:
InChi Code:

Properties

MP: Melting point [K]

ValueSource or prediction
387

experimental value

325

11: A correlation of melting points and boiling points (Training)

345

12: A correlation of melting points using boiling points and SIGMAL (Training)

374

13: A correlation of melting points using boiling points, SIGMAL, EXPAN and ORTHO (Training)

368

14: A correlation of melting points using just the geometric factors (Training)

Links to External Resources