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73-49-4

73-49-4 structural image
Product Name: QUINETHAZONE (1.5 G)
Formula: C10H12ClN3O3S
Synonyms: 7-Chloro-2-ethyl-1,2,3,4-tetrahydro-4-oxo-6-quinazolinesulfonamide
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Fibrous crystals or white powder. (NTP, 1992)
Color/Form Fibrous crystals from 50% acetone
Odor ODORLESS
Taste BITTER TASTE
Melting Point 482 to 486 °F (NTP, 1992)
Solubility less than 1 mg/mL at 67.1 °F (NTP, 1992)
Stability/Shelf Life DISCOLORS IN PRESENCE OF STRONG LIGHT & ALKALINE MATERIALS
Kovats Retention Index 3015.3 3000
Other Experimental Properties IT DIFFERS CHEMICALLY FROM THE BENZOTHIAZIDE TYPE ONLY IN REPLACEMENT OF SULFUR ATOM BY CARBON

COMPUTED DESCRIPTORS

Molecular Weight 289.74 g/mol
XLogP3 1.2
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 2
Exact Mass 289.0287901 g/mol
Monoisotopic Mass 289.0287901 g/mol
Topological Polar Surface Area 110 Ų
Heavy Atom Count 18
Formal Charge 0
Complexity 436
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

Fibrous crystals or white powder. (NTP, 1992)