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7159-86-6

7159-86-6 structural image
Product Name: 3α,6β-Ditigloyloxytropan-7β-ol
Formula: C18H27NO5
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Solid
Melting Point 215 °C
Kovats Retention Index 2429.1

COMPUTED DESCRIPTORS

Molecular Weight 337.4 g/mol
XLogP3 2.3
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 6
Exact Mass 337.18892296 g/mol
Monoisotopic Mass 337.18892296 g/mol
Topological Polar Surface Area 76.1 Ų
Heavy Atom Count 24
Formal Charge 0
Complexity 568
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 5
Defined Bond Stereocenter Count 2
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

3,6-Ditigloyloxytropan-7-ol is a tropane alkaloid.