19902-91-1
Product Name:
DIHYDROMETHYSTICIN
Formula:
C15H16O5
Synonyms:
(6S)-6-[2-(1,3-Benzodioxol-5-yl)ethyl]-5,6-dihydro-4-methoxy-2H-pyran-2-one;Dihydromethysticin
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
| Kovats Retention Index | 2571.8 |
|---|
COMPUTED DESCRIPTORS
| Molecular Weight | 276.28 g/mol |
|---|---|
| XLogP3 | 2.6 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 4 |
| Exact Mass | 276.09977361 g/mol |
| Monoisotopic Mass | 276.09977361 g/mol |
| Topological Polar Surface Area | 54 Ų |
| Heavy Atom Count | 20 |
| Formal Charge | 0 |
| Complexity | 392 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 1 |
| 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
Dihydromethysticin is a member of 2-pyranones and an aromatic ether.