CHEMICAL AND PHYSICAL PROPERTIES
Collision Cross Section | 164.5 Ų [M+H]+ [CCS Type: TW, Method: calibrated with polyalanine and drug standards] |
---|---|
Kovats Retention Index | 2198 |
COMPUTED DESCRIPTORS
Molecular Weight | 281.30 g/mol |
---|---|
XLogP3 | 0.9 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 5 |
Rotatable Bond Count | 4 |
Exact Mass | 281.12632271 g/mol |
Monoisotopic Mass | 281.12632271 g/mol |
Topological Polar Surface Area | 57.2 Ų |
Heavy Atom Count | 20 |
Formal Charge | 0 |
Complexity | 305 |
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
4-morpholinyl-(3,4,5-trimethoxyphenyl)methanone is a member of morpholines.