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76191-50-9

76191-50-9 structural image
Product Name: 2-(1,4-Dihydro-3,5-dihydroxy-1,4-dioxonaphthalen-2-yl)-3-methoxy-5-methylbenzoic acid
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COMPUTED DESCRIPTORS

Molecular Weight 354.3 g/mol
XLogP3 2.5
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 3
Exact Mass 354.07395278 g/mol
Monoisotopic Mass 354.07395278 g/mol
Topological Polar Surface Area 121 Ų
Heavy Atom Count 26
Formal Charge 0
Complexity 652
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

2-(1,5-Dihydroxy-3,4-dioxonaphthalen-2-yl)-3-methoxy-5-methylbenzoic acid is a member of naphthalenes, a ring assembly and a member of benzenes.