73809-82-2
Product Name:
(1S,8aα)-2,3,3a,5,6,7,8,8a-Octahydro-3aα-methyl-7-methylene-1α-(1-methylethyl)azulen-4(1H)-one
Formula:
C15H24O
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
| Kovats Retention Index | 1592 1595 1590 1612 1604 1602 1596 |
|---|
COMPUTED DESCRIPTORS
| Molecular Weight | 220.35 g/mol |
|---|---|
| XLogP3 | 3.6 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 1 |
| Rotatable Bond Count | 1 |
| Exact Mass | 220.182715385 g/mol |
| Monoisotopic Mass | 220.182715385 g/mol |
| Topological Polar Surface Area | 17.1 Ų |
| Heavy Atom Count | 16 |
| Formal Charge | 0 |
| Complexity | 315 |
| 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
Salvial-4(14)-en-1-one is a natural product found in Cistus creticus, Salvia sclarea, and Anthemis aciphylla with data available.