CHEMICAL AND PHYSICAL PROPERTIES
Boiling Point | 164.00 to 165.00 °C. @ 760.00 mm Hg |
---|---|
Kovats Retention Index | 960 965 |
COMPUTED DESCRIPTORS
Molecular Weight | 142.20 g/mol |
---|---|
XLogP3 | 2.1 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 2 |
Rotatable Bond Count | 6 |
Exact Mass | 142.099379685 g/mol |
Monoisotopic Mass | 142.099379685 g/mol |
Topological Polar Surface Area | 26.3 Ų |
Heavy Atom Count | 10 |
Formal Charge | 0 |
Complexity | 108 |
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
Allyl valerate is a fatty acid ester.