CHEMICAL AND PHYSICAL PROPERTIES
Collision Cross Section | 145.8 Ų [M+H]+ [CCS Type: TW, Method: calibrated with polyalanine and drug standards] |
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COMPUTED DESCRIPTORS
Molecular Weight | 193.24 g/mol |
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XLogP3 | 1.3 |
Hydrogen Bond Donor Count | 2 |
Hydrogen Bond Acceptor Count | 3 |
Rotatable Bond Count | 1 |
Exact Mass | 193.110278721 g/mol |
Monoisotopic Mass | 193.110278721 g/mol |
Topological Polar Surface Area | 41.5 Ų |
Heavy Atom Count | 14 |
Formal Charge | 0 |
Complexity | 198 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 1 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
7-methoxy-1-methyl-1,2,3,4-tetrahydroisoquinolin-6-ol is a member of isoquinolines.