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3804-70-4

3804-70-4 structural image
Product Name: 2H-Furo(2,3-h)-1-benzopyran-2-one, 8,9-dihydro-8-(1-hydroxy-1-methylet hyl)-, (S)-
Formula: C14H14O4
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CHEMICAL AND PHYSICAL PROPERTIES

Kovats Retention Index 2231.3 2227 2227

COMPUTED DESCRIPTORS

Molecular Weight 246.26 g/mol
XLogP3 1.9
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 1
Exact Mass 246.08920892 g/mol
Monoisotopic Mass 246.08920892 g/mol
Topological Polar Surface Area 55.8 Ų
Heavy Atom Count 18
Formal Charge 0
Complexity 387
Isotope Atom Count 0
Defined Atom Stereocenter Count 1
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

(S)-columbianetin is the (S)-(+)-enantiomer of columbianetin. It is an enantiomer of a (R)-columbianetin.