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4361-23-3

4361-23-3 structural image
Product Name: TETRAHYDROIONOL
Formula: C13H26O
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CHEMICAL AND PHYSICAL PROPERTIES

Kovats Retention Index 1424 1432.8

COMPUTED DESCRIPTORS

Molecular Weight 198.34 g/mol
XLogP3 4.3
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 1
Rotatable Bond Count 3
Exact Mass 198.198365449 g/mol
Monoisotopic Mass 198.198365449 g/mol
Topological Polar Surface Area 20.2 Ų
Heavy Atom Count 14
Formal Charge 0
Complexity 174
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 3
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

Tetrahydroionol is a natural product found in Citrus unshiu, Citrus deliciosa, and Citrus reticulata with data available.