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4205-90-7

4205-90-7 structural image
Product Name: CLONIDINE
Formula: C9H9Cl2N3
Synonyms: 2-(2,6-Dichloroanilino)-2-imidazoline
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Solid
Color/Form Crystals
Melting Point 130
Solubility Insoluble in water
LogP 1.59
Stability/Shelf Life STABLE IN LIGHT, AIR, & HEAT /HCL/
Decomposition When heated to decomposition it emits toxic fumes of nitroxides and /hydrogen chloride/. /Clonidine hydrochloride/
Caco2 Permeability -4.59
Dissociation Constants 8.05 (at 25 °C)
Collision Cross Section 144 Ų [M+H]+ [CCS Type: TW, Method: Major Mix IMS/Tof Calibration Kit (Waters)]
Kovats Retention Index 2023 2065 2113 2081.6

SAFETY INFORMATION

Signal word Danger
Pictogram(s)

Skull and Crossbones
Acute Toxicity
GHS06
GHS Hazard Statements H301:Acute toxicity,oral

COMPUTED DESCRIPTORS

Molecular Weight 230.09 g/mol
XLogP3 1.6
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 1
Rotatable Bond Count 2
Exact Mass 229.0173527 g/mol
Monoisotopic Mass 229.0173527 g/mol
Topological Polar Surface Area 36.4 Ų
Heavy Atom Count 14
Formal Charge 0
Complexity 222
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

Clonidine (imino form) is a clonidine. It is a tautomer of a clonidine (amino form).

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