CHEMICAL AND PHYSICAL PROPERTIES
Physical Description | clear colourless liquid |
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Boiling Point | 67.00 to 68.00 °C. @ 760.00 mm Hg |
Solubility | insoluble in water; soluble in ethanol, triacetin and heptane |
Density | 0.964-0.969 |
Refractive Index | 1.492-1.497 |
COMPUTED DESCRIPTORS
Molecular Weight | 144.24 g/mol |
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XLogP3 | 2.2 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 2 |
Rotatable Bond Count | 3 |
Exact Mass | 144.06088618 g/mol |
Monoisotopic Mass | 144.06088618 g/mol |
Topological Polar Surface Area | 42.4 Ų |
Heavy Atom Count | 9 |
Formal Charge | 0 |
Complexity | 123 |
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
S-(3-Methyl-2-butenyl) ethanethioate is a thiocarboxylic ester.