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56795-51-8

56795-51-8 structural image
Product Name: Scopoletin acetate
Formula: C12H10O5
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Solid
Melting Point 177 °C
Kovats Retention Index 2079

COMPUTED DESCRIPTORS

Molecular Weight 234.20 g/mol
XLogP3 1.6
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 3
Exact Mass 234.05282342 g/mol
Monoisotopic Mass 234.05282342 g/mol
Topological Polar Surface Area 61.8 Ų
Heavy Atom Count 17
Formal Charge 0
Complexity 349
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

7-Acetoxy-6-methoxycoumarin is a member of coumarins.