CHEMICAL AND PHYSICAL PROPERTIES
Kovats Retention Index | 2006.7 |
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COMPUTED DESCRIPTORS
Molecular Weight | 230.30 g/mol |
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XLogP3 | 2.6 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 2 |
Rotatable Bond Count | 0 |
Exact Mass | 230.130679813 g/mol |
Monoisotopic Mass | 230.130679813 g/mol |
Topological Polar Surface Area | 26.3 Ų |
Heavy Atom Count | 17 |
Formal Charge | 0 |
Complexity | 432 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 4 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
3,6,9-Trimethylidene-3a,4,5,6a,7,8,9a,9b-octahydroazuleno[4,5-b]furan-2-one is a sesquiterpene lactone.