CHEMICAL AND PHYSICAL PROPERTIES
Physical Description | Solid |
---|---|
Solubility | >32.7 [ug/mL] (The mean of the results at pH 7.4) |
Collision Cross Section | 151.5 Ų [M+H]+ [CCS Type: DT, Method: single field calibrated with Agilent tune mix (Agilent)] |
Kovats Retention Index | 1960 |
COMPUTED DESCRIPTORS
Molecular Weight | 218.29 g/mol |
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XLogP3 | 1.5 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 2 |
Rotatable Bond Count | 4 |
Exact Mass | 218.141913202 g/mol |
Monoisotopic Mass | 218.141913202 g/mol |
Topological Polar Surface Area | 28.3 Ų |
Heavy Atom Count | 16 |
Formal Charge | 0 |
Complexity | 220 |
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
5-methoxy-N,N-dimethyltryptamine is a tryptamine alkaloid that is N,N-dimethyltryptamine substituted by a methoxy group at position 5. It has a role as a hallucinogen and a plant metabolite. It is a tryptamine alkaloid, an aromatic ether and a tertiary amino compound. It is functionally related to a bufotenin.