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19988-24-0

19988-24-0 structural image
Product Name: ATRAZINE-DESETHYL-2-HYDROXY
Formula: C6H11N5O
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COMPUTED DESCRIPTORS

Molecular Weight 169.19 g/mol
XLogP3 -0.6
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 1
Rotatable Bond Count 2
Exact Mass 169.09635999 g/mol
Monoisotopic Mass 169.09635999 g/mol
Topological Polar Surface Area 91.9 Ų
Heavy Atom Count 12
Formal Charge 0
Complexity 255
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

Atrazine-desethyl-2-hydroxy is a diamino-1,3,5-triazine that is N-(propan-2-yl)-1,3,5-triazine-2,4-diamine substituted by a hydroxy group at position 2. It is a metabolite of the herbicide atrazine. It has a role as a marine xenobiotic metabolite. It is a diamino-1,3,5-triazine and a heteroaryl hydroxy compound.