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911-45-5

911-45-5 structural image
Product Name: Clomifene
Formula: C26H28ClNO
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CHEMICAL AND PHYSICAL PROPERTIES

Melting Point MP: 116.5-118 °C /CITRATE/
Solubility SLIGHTLY SOL IN WATER (1 IN 900), ETHANOL (1 IN 40) AND CHLOROFORM (1 IN 800); FREELY SOL IN METHANOL; PRACTICALLY INSOL IN DIETHYL ETHER /CITRATE/
Stability/Shelf Life UNSTABLE TO AIR AND LIGHT
Kovats Retention Index 2915.6 2930
Other Experimental Properties APPRECIABLY HYGROSCOPIC; MELTS WITH DECOMP BETWEEN 117 AND 119 °C /CITRATE/

COMPUTED DESCRIPTORS

Molecular Weight 406.0 g/mol
XLogP3 7.2
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 9
Exact Mass 405.1859422 g/mol
Monoisotopic Mass 405.1859422 g/mol
Topological Polar Surface Area 12.5 Ų
Heavy Atom Count 29
Formal Charge 0
Complexity 481
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

Zuclomifene is a stilbenoid.