CHEMICAL AND PHYSICAL PROPERTIES
Physical Description | Liquid |
---|---|
Kovats Retention Index | 2993 2995 |
COMPUTED DESCRIPTORS
Molecular Weight | 420.8 g/mol |
---|---|
XLogP3 | 16.5 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 0 |
Rotatable Bond Count | 27 |
Exact Mass | 420.469501914 g/mol |
Monoisotopic Mass | 420.469501914 g/mol |
Topological Polar Surface Area | 0 Ų |
Heavy Atom Count | 30 |
Formal Charge | 0 |
Complexity | 292 |
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
1-Triacontene is a natural product found in Commiphora myrrha with data available.