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15121-94-5

15121-94-5 structural image
Product Name: PRIMIN
Formula: C12H16O3
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COMPUTED DESCRIPTORS

Molecular Weight 208.25 g/mol
XLogP3 2.6
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 5
Exact Mass 208.109944368 g/mol
Monoisotopic Mass 208.109944368 g/mol
Topological Polar Surface Area 43.4 Ų
Heavy Atom Count 15
Formal Charge 0
Complexity 324
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

Primin is a 1,4-benzoquinone having a methoxy substituent at the 2-position and a pentyl substituent at the 6-position. It has a role as a hapten, a metabolite, an antimicrobial agent, an antifeedant and an allergen.