CHEMICAL AND PHYSICAL PROPERTIES
Physical Description | colourless to pale yellow, slightly oily liquid with floral odour similar to jasmine |
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Solubility | slightly soluble in water; soluble in alcohol and oils |
Density | 0.964-0.978 |
Refractive Index | 1.441-1.453 |
COMPUTED DESCRIPTORS
Molecular Weight | 202.29 g/mol |
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XLogP3 | 2.7 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 3 |
Rotatable Bond Count | 9 |
Exact Mass | 202.15689456 g/mol |
Monoisotopic Mass | 202.15689456 g/mol |
Topological Polar Surface Area | 46.5 Ų |
Heavy Atom Count | 14 |
Formal Charge | 0 |
Complexity | 146 |
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-hydroxynonyl acetate is an acetate ester resulting from the formal condensation of the carboxy group of acetic acid with 1-hydroxy group of nonane-1,3-diol. It is a secondary alcohol and an acetate ester.