CHEMICAL AND PHYSICAL PROPERTIES
Physical Description | clear colourless liquid |
---|---|
Boiling Point | 206.00 to 207.00 °C. @ 760.00 mm Hg |
Solubility | insoluble in water; soluble in ethanol, triacetin and heptane |
Density | 0.967-0.968 |
Refractive Index | 1.475-1.485 |
Kovats Retention Index | 1102 1100 |
COMPUTED DESCRIPTORS
Molecular Weight | 146.25 g/mol |
---|---|
XLogP3 | 1.6 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 2 |
Rotatable Bond Count | 5 |
Exact Mass | 146.07653624 g/mol |
Monoisotopic Mass | 146.07653624 g/mol |
Topological Polar Surface Area | 42.4 Ų |
Heavy Atom Count | 9 |
Formal Charge | 0 |
Complexity | 73.3 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 1 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
3-(Methylthio)hexanal is an aldehyde.