CHEMICAL AND PHYSICAL PROPERTIES
Kovats Retention Index | 1473 1476 1472 |
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COMPUTED DESCRIPTORS
Molecular Weight | 214.34 g/mol |
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XLogP3 | 5.1 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 2 |
Rotatable Bond Count | 11 |
Exact Mass | 214.193280068 g/mol |
Monoisotopic Mass | 214.193280068 g/mol |
Topological Polar Surface Area | 26.3 Ų |
Heavy Atom Count | 15 |
Formal Charge | 0 |
Complexity | 144 |
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
Propyl decanoate is a decanoate ester obtained by the formal condensation of carboxy group of decanoic acid with propanol. It has a role as a Saccharomyces cerevisiae metabolite. It is functionally related to a decanoic acid and a propan-1-ol.