CHEMICAL AND PHYSICAL PROPERTIES
Physical Description | colourless liquid |
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Boiling Point | 157.00 to 158.00 °C. @ 760.00 mm Hg |
Solubility | insoluble in water; soluble in peanut oil and ethanol |
Density | 0.935-0.940 |
Refractive Index | 1.455-1.461 |
Kovats Retention Index | 923 913 921 |
COMPUTED DESCRIPTORS
Molecular Weight | 132.23 g/mol |
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XLogP3 | 1.9 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 2 |
Rotatable Bond Count | 3 |
Exact Mass | 132.06088618 g/mol |
Monoisotopic Mass | 132.06088618 g/mol |
Topological Polar Surface Area | 42.4 Ų |
Heavy Atom Count | 8 |
Formal Charge | 0 |
Complexity | 78.6 |
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-Methyl 3-methylthiobutyrate is a thiocarboxylic ester.