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Homecas83657-19-6

83657-19-6

83657-19-6 structural image
Product Name: Diniconazole (+)-form
Formula: C15H17Cl2N3O
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COMPUTED DESCRIPTORS

Molecular Weight 326.2 g/mol
XLogP3 4.2
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 4
Exact Mass 325.0748676 g/mol
Monoisotopic Mass 325.0748676 g/mol
Topological Polar Surface Area 50.9 Ų
Heavy Atom Count 21
Formal Charge 0
Complexity 384
Isotope Atom Count 0
Defined Atom Stereocenter Count 1
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

(S)-diniconazole is a (1E)-1-(2,4-dichlorophenyl)-4,4-dimethyl-2-(1,2,4-triazol-1-yl)pent-1-en-3-ol that is the (S)-enantiomer of diniconazole. It is an enantiomer of a diniconazole-M.