489-86-1
Product Name:
(-)-GUAIOL
Formula:
C15H26O
Synonyms:
(3R,6S,10S)-6,10,α,α-Tetramethylbicyclo[5.3.0]dec-1(7)-ene-3-methanol
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
Collision Cross Section | 146.3 Ų [M+H]+ [CCS Type: TW, Method: calibrated with polyalanine and drug standards] |
---|
COMPUTED DESCRIPTORS
Molecular Weight | 222.37 g/mol |
---|---|
XLogP3 | 3.1 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 1 |
Rotatable Bond Count | 1 |
Exact Mass | 222.198365449 g/mol |
Monoisotopic Mass | 222.198365449 g/mol |
Topological Polar Surface Area | 20.2 Ų |
Heavy Atom Count | 16 |
Formal Charge | 0 |
Complexity | 301 |
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
Guaiol is a guaiane sesquiterpenoid.