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580-73-4

580-73-4 structural image
Product Name: 2(3H)-Furanone, 3,4-bis(1,3-benzodioxol-5-ylmethyl)dihydro-, (3S,4S)-
Formula: C20H18O6
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CHEMICAL AND PHYSICAL PROPERTIES

Kovats Retention Index 3096.2

COMPUTED DESCRIPTORS

Molecular Weight 354.4 g/mol
XLogP3 3.7
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 4
Exact Mass 354.11033829 g/mol
Monoisotopic Mass 354.11033829 g/mol
Topological Polar Surface Area 63.2 Ų
Heavy Atom Count 26
Formal Charge 0
Complexity 524
Isotope Atom Count 0
Defined Atom Stereocenter Count 2
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

2(3H)-Furanone, dihydro-3,4-dipiperonyl-, trans-(-)- is a natural product found in Podolepis rugata, Piper nigrum, and other organisms with data available.