CHEMICAL AND PHYSICAL PROPERTIES
Physical Description | colourless to pale yellow liquid |
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Boiling Point | 142.00 °C. @ 760.00 mm Hg |
Solubility | insoluble in water; soluble in most organic solvents |
Density | 0.848-0.853 (20°) |
Refractive Index | 1.394-1.399 |
Kovats Retention Index | 880 894 874 874 873 883 874 883 |
COMPUTED DESCRIPTORS
Molecular Weight | 144.21 g/mol |
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XLogP3 | 2.2 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 2 |
Rotatable Bond Count | 4 |
Exact Mass | 144.115029749 g/mol |
Monoisotopic Mass | 144.115029749 g/mol |
Topological Polar Surface Area | 26.3 Ų |
Heavy Atom Count | 10 |
Formal Charge | 0 |
Complexity | 106 |
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
Isopropyl 3-methylbutanoate is a fatty acid ester.