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644-31-5

644-31-5 structural image
Product Name: Acetyl benzoyl peroxide
Formula: C9H8O4
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Acetyl benzoyl peroxide appears as a solution containing less than 40% by mass of the white crystalline solid in a nonvolatile solvent. Dilution moderates reactivity of the pure solvent. Irritating to the skin, eyes and mucous membranes.
Color/Form White crystals
Boiling Point 130 °C @ 19 mm Hg
Melting Point 37 °C
Solubility Moderately soluble in ether, chloroform, and carbon tetrachloride; slightly soluble in mineral oils and alcohol.
Other Experimental Properties Decomp on contact with moisture or in warm place.
Chemical Classes Other Classes -> Peroxides, Organic

COMPUTED DESCRIPTORS

Molecular Weight 180.16 g/mol
XLogP3 1.9
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 4
Exact Mass 180.04225873 g/mol
Monoisotopic Mass 180.04225873 g/mol
Topological Polar Surface Area 52.6 Ų
Heavy Atom Count 13
Formal Charge 0
Complexity 194
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

Acetyl benzoyl peroxide appears as a solution containing less than 40% by mass of the white crystalline solid in a nonvolatile solvent. Dilution moderates reactivity of the pure solvent. Irritating to the skin, eyes and mucous membranes.