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61-57-4

61-57-4 structural image
Product Name: niridazole
Formula: C6H6N4O3S
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CHEMICAL AND PHYSICAL PROPERTIES

Color/Form Yellow crystals from dimethylformamide/methanol
Melting Point 260-262 °C
Solubility Insoluble in most organic solvents; soluble in dimethylformamide
LogP log Kow = 0.95

COMPUTED DESCRIPTORS

Molecular Weight 214.20 g/mol
XLogP3 0.9
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 1
Exact Mass 214.01606124 g/mol
Monoisotopic Mass 214.01606124 g/mol
Topological Polar Surface Area 119 Ų
Heavy Atom Count 14
Formal Charge 0
Complexity 268
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

Niridazole is a C-nitro compound and a member of 1,3-thiazoles.