83161-56-2
Product Name:
5-Azuleneacetic acid, 1,2,4,5,6,7,8,8a-octahydro-3,8-dimethyl-α-methylene-2-oxo-, (5R,8S,8aS)-
Formula:
C15H20O3
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 248.32 g/mol |
|---|---|
| XLogP3 | 2.4 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 2 |
| Exact Mass | 248.14124450 g/mol |
| Monoisotopic Mass | 248.14124450 g/mol |
| Topological Polar Surface Area | 54.4 Ų |
| Heavy Atom Count | 18 |
| Formal Charge | 0 |
| Complexity | 445 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 3 |
| 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
Pechueloic acid is a sesquiterpenoid.