CHEMICAL AND PHYSICAL PROPERTIES
Boiling Point | 209 °C |
---|---|
Melting Point | < 25 °C |
Solubility | 1000000 mg/L (at 25 °C) |
LogP | 0.35 |
LogS | 0.81 |
Dissociation Constants | 7.64 |
Kovats Retention Index | 1195 |
COMPUTED DESCRIPTORS
Molecular Weight | 155.19 g/mol |
---|---|
XLogP3 | 0.3 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 3 |
Rotatable Bond Count | 2 |
Exact Mass | 155.094628657 g/mol |
Monoisotopic Mass | 155.094628657 g/mol |
Topological Polar Surface Area | 29.5 Ų |
Heavy Atom Count | 11 |
Formal Charge | 0 |
Complexity | 187 |
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
Arecoline is a tetrahydropyridine that is 1,2,5,6-tetrahydropyridine with a methyl group at position 1, and a methoxycarbonyl group at position 3. An alkaloid found in the areca nut, it acts as an agonist of muscarinic acetylcholine. It has a role as a muscarinic agonist and a metabolite. It is a tetrahydropyridine, an enoate ester, a pyridine alkaloid and a methyl ester.