CHEMICAL AND PHYSICAL PROPERTIES
Physical Description | Liquid |
---|---|
Boiling Point | 306.00 to 307.00 °C. @ 760.00 mm Hg |
Melting Point | -18.1 °C |
Solubility | soluble in alcohol; insoluble in water |
Density | 0.8554 |
Refractive Index | 1.4352-1.4925 |
Kovats Retention Index | 1767 1771 1759 1763 |
COMPUTED DESCRIPTORS
Molecular Weight | 256.42 g/mol |
---|---|
XLogP3 | 6.5 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 2 |
Rotatable Bond Count | 14 |
Exact Mass | 256.240230259 g/mol |
Monoisotopic Mass | 256.240230259 g/mol |
Topological Polar Surface Area | 26.3 Ų |
Heavy Atom Count | 18 |
Formal Charge | 0 |
Complexity | 178 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 0 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
Octyl octanoate is a carboxylic ester.