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118409-60-2

118409-60-2 structural image
Product Name: AG 213
Formula: C10H8N2O2S
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COMPUTED DESCRIPTORS

Molecular Weight 220.25 g/mol
XLogP3 1
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 2
Exact Mass 220.03064868 g/mol
Monoisotopic Mass 220.03064868 g/mol
Topological Polar Surface Area 122 Ų
Heavy Atom Count 15
Formal Charge 0
Complexity 332
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 1
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

3-amino-2-[(3-hydroxy-4-oxo-1-cyclohexa-2,5-dienylidene)methyl]-3-mercapto-2-propenenitrile is a member of quinomethanes.