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492-89-7

492-89-7 structural image
Product Name: 3-PENTADECYLCATECHOL
Formula: C21H36O2
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COMPUTED DESCRIPTORS

Molecular Weight 320.5 g/mol
XLogP3 9
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 14
Exact Mass 320.271530387 g/mol
Monoisotopic Mass 320.271530387 g/mol
Topological Polar Surface Area 40.5 Ų
Heavy Atom Count 23
Formal Charge 0
Complexity 254
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

3-pentadecylcatechol is catechol substituted at position 3 with a pentadecyl group. It has a role as an allergen.